NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2901 8.2493 123.5685 51.5609 19.1887 176.1914 2 P 4.2879 0.0000 0.0000 64.0144 33.1846 174.0826 3 L 4.9396 8.6268 123.9877 53.2421 45.2014 176.7039 4 T 4.9525 8.5935 121.7225 61.8758 72.7364 172.6848 5 I 4.7511 8.6429 127.3627 59.9841 39.5714 174.6652 6 T 4.9858 9.1888 124.5067 61.6936 71.6282 173.1463 7 N 5.1611 8.9926 125.0107 52.4036 40.0602 174.6192 8 R 4.6163 8.9219 125.0753 56.1289 30.9341 176.4266 9 C 4.1738 7.9260 116.7158 56.7612 40.6998 173.3924 10 H 4.4869 7.9395 117.3260 56.2308 28.4920 175.0332 11 F 5.1602 6.3520 113.7446 54.7306 41.2136 174.7951 12 T 3.9890 8.7200 116.7550 63.9092 68.7082 174.2978 13 V 4.6471 8.1668 119.0199 59.5050 35.5571 174.9908 14 W 4.9058 9.3871 124.5394 53.2141 29.7659 173.2067 15 P 4.8308 0.0000 0.0000 62.3701 32.7467 174.9082 16 A 4.8594 8.8610 124.2708 50.0347 22.4088 174.9846 17 V 4.8524 9.2517 122.4963 60.9371 34.2804 174.3122 18 A 5.1073 9.1660 128.8940 49.9498 22.4518 175.4045 19 L 4.2261 8.6995 122.0113 54.7874 42.5134 179.0414 20 V 3.4553 8.2195 115.4369 63.7623 31.5756 177.4241 21 L 4.6022 7.9065 116.1244 54.1585 42.4844 175.6061 22 A 4.8098 7.5606 122.7455 50.2210 21.0009 178.6393 23 Q 4.0379 8.8023 119.9429 58.5493 29.1868 176.2247 24 G 4.5172 7.3390 100.2509 45.8104 0.0000 170.5729 25 G 4.3322 8.3584 105.3593 45.7951 0.0000 172.1833 26 G 4.4424 8.9130 106.6789 44.9682 0.0000 172.2858 27 G 4.1026 7.9545 105.2873 46.3731 0.0000 171.3471 28 T 4.2234 6.9940 112.7755 60.7242 71.4768 172.2614 29 E 3.8278 8.2679 123.6873 54.1952 31.1293 174.9491 30 L 4.4246 7.8661 127.6364 52.9072 43.8609 176.0173 31 H 4.3802 8.3940 121.3148 54.5235 30.3319 173.4910 32 P 4.1102 0.0000 0.0000 64.9953 31.3038 176.8717 33 G 3.9113 8.9607 112.2214 44.7517 0.0000 173.1235 34 A 4.5584 8.0371 121.9423 51.2872 20.4742 176.5811 35 S 5.2875 8.5626 114.7965 56.3976 67.2102 173.5912 36 W 4.9914 9.1519 131.8068 55.8830 32.9275 174.4113 37 S 4.8852 8.8894 124.1467 57.9742 63.3308 173.8684 38 L 4.5295 9.0992 124.8435 52.7242 45.4436 174.9336 39 D 5.0543 8.4464 121.1682 53.1304 42.6725 175.5714 40 T 4.5755 8.2557 115.0025 58.9958 70.8847 172.6499 41 P 4.5572 0.0000 0.0000 62.3721 32.2456 176.9211 42 V 3.7439 8.1710 112.2779 64.0125 31.7238 176.3479 43 I 5.1222 6.9833 116.4463 60.0342 40.9436 172.9074 44 G 3.8950 8.8447 110.0060 44.3416 0.0000 172.3933 45 S 5.2932 8.3455 111.8324 56.5280 66.6800 173.0534 46 Q 4.9079 9.1197 119.5752 54.4938 33.0289 173.9250 47 Y 5.3420 9.6841 121.3076 57.3844 40.3026 174.7715 48 I 5.3019 9.7758 124.1879 59.4893 41.2901 174.4601 49 W 5.7439 9.0387 123.0929 55.2697 31.9286 173.9160 50 G 4.0826 9.1267 107.9349 44.8953 0.0000 173.1455 51 R 5.4277 8.7635 120.7271 53.3249 33.8040 174.9131 52 T 4.9683 8.1335 111.6886 60.1028 72.1138 173.6065 53 G 3.5124 8.6493 107.9812 46.9057 0.0000 173.9902 54 C 4.2348 6.7586 116.0221 55.1001 37.1293 174.1090 55 S 4.2648 7.4885 118.9250 56.3707 64.2907 172.5581 56 F 5.5601 8.3396 125.5534 55.8412 42.2650 175.7034 57 D 4.8152 8.3511 121.9490 52.2197 41.5858 177.0052 58 R 3.9588 8.5247 114.1042 59.3604 29.7613 177.9049 59 A 4.0880 8.5000 121.7085 54.3152 18.5115 177.7497 60 G 4.6998 7.3831 101.6546 42.9944 0.0000 172.6886 61 K 4.2581 8.7037 124.3394 55.3662 32.8606 176.8013 62 G 4.7046 7.4631 109.2578 45.3203 0.0000 171.1855 63 R 4.8632 7.1949 118.1333 54.7204 33.8692 174.4064 64 C 4.7372 8.6587 120.5990 54.8077 41.5994 174.0332 65 Q 4.1243 8.3578 124.0784 58.8372 29.2076 176.5606 66 T 4.4726 7.1962 110.0294 60.2846 72.2916 174.6839 67 G 3.9502 8.2290 111.8666 46.4551 0.0000 173.0616 68 D 4.4362 8.0495 119.9005 53.9846 41.8280 175.5615 69 C 4.8477 8.8917 127.0993 55.3980 43.5282 172.8755 70 G 3.9430 9.5561 112.6620 45.8070 0.0000 173.3092 71 G 4.0372 7.8104 105.2757 45.4307 0.0000 175.9543 72 S 3.5960 8.9207 117.0652 61.3215 62.7883 175.0665 73 S 4.3715 7.7478 117.0511 57.5038 62.4611 174.5152 74 L 5.0536 8.5380 130.2348 54.3699 41.2775 177.0755 75 T 5.0599 7.6801 107.9842 59.9562 70.3157 173.4240 76 C 4.8223 8.9028 121.6453 57.5499 41.2615 173.8997 77 G 4.2003 7.8939 107.4940 44.8390 0.0000 174.0338 78 G 4.1130 9.1631 111.2137 45.6282 0.0000 173.8024 79 N 4.6227 7.0899 116.4987 50.5603 37.8103 172.3999 80 P 4.4399 0.0000 0.0000 61.5291 32.4335 177.0264 81 A 4.0295 8.0644 121.9079 51.7862 18.7924 177.3622 82 V 4.0928 8.1700 122.7263 62.5131 32.1294 173.7502 83 P 5.0595 0.0000 0.0000 62.5017 33.2663 174.7111 84 T 4.6617 8.2419 113.4009 61.5296 70.7979 172.8469 85 T 4.3864 9.4387 125.9736 63.3671 69.7004 174.0282 86 M 4.7901 8.8358 125.7416 53.7061 34.3624 174.6175 87 A 5.2593 9.1224 126.4929 50.3241 21.8313 175.0139 88 E 5.2093 9.6657 122.9112 54.3530 33.0216 174.7678 89 V 4.9350 8.9615 126.4060 61.3945 34.6549 174.1116 90 S 5.2744 8.9587 124.1989 56.9611 65.6575 173.3275 91 V 4.9358 9.1518 123.6569 61.1269 33.7684 174.3704 92 L 4.7343 8.5876 129.5905 53.2428 44.6096 174.3439 93 Q 3.8535 8.5997 122.6954 59.2875 28.5243 175.7305 94 G 4.1015 8.9079 115.0710 45.2853 0.0000 172.3367 95 N 4.6754 7.2866 116.9644 52.4946 40.1322 174.0854 96 Y 5.4904 9.1537 120.2718 56.4353 42.2086 174.6853 97 T 5.1920 8.9962 112.2984 60.0539 72.2319 172.3438 98 Y 5.3459 8.4396 122.0776 55.4787 41.2688 174.4348 99 G 4.3708 9.5669 110.6143 44.6800 0.0000 171.2393 100 V 5.2699 8.2476 118.1460 60.8766 34.7577 173.4774 101 T 5.1255 9.4458 116.7181 60.1701 71.3704 173.4505 102 S 5.4169 9.8497 120.5982 57.8167 62.6541 175.1295 103 T 4.4860 8.4153 117.8607 65.4943 71.1582 176.5963 104 L 3.9912 8.1824 122.0496 57.4523 42.4388 177.4511 105 K 4.4637 8.2678 114.5670 55.7417 33.6939 176.0701 106 G 4.1838 9.2908 105.6388 44.1932 0.0000 172.0112 107 F 4.9650 8.4305 121.4906 56.8892 42.5865 173.9926 108 N 4.6593 8.2183 123.1992 53.5049 38.9887 174.8672 109 V 4.4723 6.8810 117.1040 59.3644 34.5012 173.3533 110 P 4.9982 0.0000 0.0000 63.5224 32.5075 175.0486 111 M 5.3666 9.9882 122.7245 53.7039 36.5041 174.4731 112 N 5.2739 8.9655 117.8312 51.7890 42.6733 173.3439 113 L 5.0820 8.6616 125.0437 53.0401 43.7648 176.0856 114 K 4.8184 9.0962 122.5914 55.2367 36.5258 174.3056 115 C 5.3461 8.3762 121.0062 54.5942 46.4741 174.9477 116 S 4.0222 8.7923 119.3043 60.3308 62.8016 175.0166 117 S 4.5996 8.1164 115.0183 58.0877 64.4904 173.3226 118 G 4.3509 7.4127 107.8670 42.8977 0.0000 172.2229 119 D 4.7912 8.3264 118.0185 52.6035 42.3444 176.5138 120 A 4.1882 8.3728 123.3472 52.0983 19.5053 177.2324 121 L 4.5781 9.1468 124.7384 52.5929 43.6549 173.6701 122 P 4.8402 0.0000 0.0000 62.7868 33.0228 177.3864 123 C 5.0011 9.3370 121.5928 56.1194 44.5960 173.7770 124 R 3.6574 8.5037 121.5331 55.8397 31.3859 175.5953 125 K 3.5359 7.4322 116.3044 53.5987 35.6282 174.8111 126 A 3.8633 7.1910 123.2321 53.3518 18.5469 177.6606 127 G 3.8526 8.7264 110.8220 45.9887 0.0000 172.8109 128 C 4.1626 8.1498 116.6620 57.0952 42.2112 173.0260 129 D 3.6879 7.5237 119.9699 51.3614 38.8547 176.1235 130 V 3.6679 7.9855 125.4078 65.3903 31.8606 176.5491 131 V 4.4862 7.1159 115.5018 60.4778 33.7667 173.2679 132 Q 4.4722 8.4750 121.3501 54.7476 29.6350 173.7764 133 P 4.5820 0.0000 0.0000 62.3208 32.0600 175.7900 134 Y 4.6859 9.0825 126.5067 56.1026 37.8059 173.6675 135 A 4.7404 7.8113 123.9617 49.9420 22.9745 174.8447 136 K 4.5507 8.1066 117.9102 54.3812 36.3337 175.4948 137 S 5.0663 8.3108 115.7192 56.8215 65.7742 173.9023 138 C 5.0077 9.5103 121.5861 55.2648 46.8499 173.1695 139 S 4.8719 8.7472 119.7983 56.6269 62.1563 172.1995 140 A 4.7429 8.0135 124.8603 49.3297 22.7419 176.4223 141 A 4.1565 8.8463 122.5118 54.7079 18.5541 179.2730 142 G 4.2138 7.6826 103.6695 45.0796 0.0000 172.8780 143 S 4.5726 8.1496 113.5396 57.8718 64.9903 173.8066 144 R 4.6241 8.9231 118.8177 54.5889 33.8202 174.6328 145 L 4.5500 8.6603 125.2104 53.7992 43.6688 175.8131 146 Q 4.8311 9.0223 123.8610 54.4113 32.5604 173.5144 147 I 4.6754 8.5503 127.5886 59.5776 39.4776 174.6373 148 V 4.6275 8.6222 127.5731 61.0310 34.2064 174.1796 149 F 4.9322 9.0715 126.7512 56.9822 40.5874 174.8276 150 C 4.0907 8.6592 120.5022 57.4530 37.6555 171.5959 151 P 4.4157 0.0000 0.0000 62.9562 30.9657 177.2005 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 A 8.25 4.29 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 2 P 0.00 4.29 0.00 2.21 2.35 0.00 3.72 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.03 0.00 3 L 8.63 4.94 0.00 1.53 1.42 0.69 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.59 4.95 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 1.18 0.00 0.00 5 I 8.64 4.75 2.08 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.57 1.18 0.00 0.00 6 T 9.19 4.99 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 1.21 0.00 0.00 7 N 8.99 5.16 0.00 2.88 2.77 0.00 0.00 6.87 6.98 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 8 R 8.92 4.62 0.00 1.90 1.93 0.00 3.19 0.00 0.00 3.20 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 9 C 7.93 4.17 0.00 2.33 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 H 7.94 4.49 0.00 3.16 3.30 0.00 5.64 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 F 6.35 5.16 0.00 3.01 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 12 T 8.72 3.99 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 0.14 0.00 0.00 13 V 8.17 4.65 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 0.84 0.00 0.00 0.53 0.00 0.00 14 W 9.39 4.91 0.00 3.35 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 P 0.00 4.83 0.00 2.33 2.26 0.00 3.52 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.17 0.00 16 A 8.86 4.86 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 V 9.25 4.85 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 0.99 0.00 0.00 0.91 0.00 0.00 18 A 9.17 5.11 1.57 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 0.00 0.00 0.00 0.00 0.00 0.00 19 L 8.70 4.23 0.00 1.70 1.61 0.94 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 20 V 8.22 3.46 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 -0.05 0.00 0.00 0.85 0.00 0.00 21 L 7.91 4.60 0.00 1.61 1.67 0.93 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 22 A 7.56 4.81 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 23 Q 8.80 4.04 0.00 2.16 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.53 0.00 0.00 0.00 0.00 0.00 2.48 2.40 0.00 24 G 7.34 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 0.00 0.00 0.00 0.00 25 G 8.36 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 26 G 8.91 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 G 7.95 4.10 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 0.00 0.00 0.00 28 T 6.99 4.22 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 0.22 0.00 0.00 29 E 8.27 3.83 0.00 1.96 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 0.00 1.62 1.47 0.00 30 L 7.87 4.42 0.00 1.53 1.42 1.09 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 31 H 8.39 4.38 0.00 3.06 3.15 0.00 5.85 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 P 0.00 4.11 0.00 2.00 2.13 0.00 3.63 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 2.02 2.10 0.00 33 G 8.96 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 34 A 8.04 4.56 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 35 S 8.56 5.29 0.00 3.75 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 36 W 9.15 4.99 0.00 3.25 3.02 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 37 S 8.89 4.89 0.00 3.79 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 38 L 9.10 4.53 0.00 1.18 1.12 -0.29 -0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 39 D 8.45 5.05 0.00 2.62 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 40 T 8.26 4.58 4.39 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 1.14 0.00 0.00 41 P 0.00 4.56 0.00 2.38 2.10 0.00 3.80 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 42 V 8.17 3.74 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 0.67 0.00 0.00 0.92 0.00 0.00 43 I 6.98 5.12 1.86 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 1.29 1.78 0.91 0.00 0.00 44 G 8.84 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 45 S 8.35 5.29 0.00 3.98 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 46 Q 9.12 4.91 0.00 1.94 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.91 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 47 Y 9.68 5.34 0.00 3.34 3.24 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 48 I 9.78 5.30 2.00 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 1.32 0.88 1.00 0.00 0.00 49 W 9.04 5.74 0.00 3.59 3.34 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 50 G 9.13 4.08 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 0.00 0.00 0.00 51 R 8.76 5.43 0.00 2.00 1.98 0.00 3.23 0.00 0.00 3.64 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.59 0.00 52 T 8.13 4.97 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 1.28 0.00 0.00 53 G 8.65 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 C 6.76 4.23 0.00 1.23 1.46 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.49 4.26 0.00 3.54 3.40 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.34 5.56 0.00 2.94 2.79 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 57 D 8.35 4.82 0.00 2.87 2.86 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 58 R 8.52 3.96 0.00 1.95 2.13 0.00 3.04 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 59 A 8.50 4.09 1.30 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 0.00 0.00 0.00 60 G 7.38 4.70 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 0.00 0.00 0.00 61 K 8.70 4.26 0.00 1.86 1.77 0.00 1.70 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.45 7.81 62 G 7.46 4.70 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 0.00 0.00 0.00 63 R 7.19 4.86 0.00 1.80 1.61 0.00 3.10 0.00 0.00 3.29 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.76 0.00 64 C 8.66 4.74 0.00 2.87 3.02 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 65 Q 8.36 4.12 0.00 1.96 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.62 0.00 0.00 0.00 0.00 0.00 2.30 2.23 0.00 66 T 7.20 4.47 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 1.17 0.00 0.00 67 G 8.23 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 68 D 8.05 4.44 0.00 2.95 2.57 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 0.00 0.00 0.00 0.00 69 C 8.89 4.85 0.00 3.35 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 70 G 9.56 3.94 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 0.00 0.00 0.00 71 G 7.81 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 0.00 0.00 0.00 72 S 8.92 3.60 0.00 3.70 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 73 S 7.75 4.37 0.00 3.98 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 74 L 8.54 5.05 0.00 1.93 1.83 0.94 0.89 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 75 T 7.68 5.06 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 1.29 0.00 0.00 76 C 8.90 4.82 0.00 3.08 3.12 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 77 G 7.89 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 0.00 0.00 0.00 0.00 78 G 9.16 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 79 N 7.09 4.62 0.00 2.71 2.65 0.00 0.00 6.95 7.90 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 80 P 0.00 4.44 0.00 1.77 1.63 0.00 3.25 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.44 0.00 81 A 8.06 4.03 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 82 V 8.17 4.09 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 0.86 0.00 0.00 0.88 0.00 0.00 83 P 0.00 5.06 0.00 2.35 2.04 0.00 3.83 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.96 0.00 84 T 8.24 4.66 4.17 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 1.03 0.00 0.00 85 T 9.44 4.39 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 1.37 0.00 0.00 86 M 8.84 4.79 0.00 1.97 1.97 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.41 0.00 87 A 9.12 5.26 1.43 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 0.00 0.00 0.00 88 E 9.67 5.21 0.00 2.15 1.87 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 2.10 2.45 0.00 89 V 8.96 4.93 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 0.94 0.00 0.00 0.96 0.00 0.00 90 S 8.96 5.27 0.00 3.85 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 91 V 9.15 4.94 2.14 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 1.01 0.00 0.00 1.16 0.00 0.00 92 L 8.59 4.73 0.00 1.76 1.42 0.89 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 93 Q 8.60 3.85 0.00 1.92 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 5.32 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 94 G 8.91 4.10 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 0.00 0.00 0.00 95 N 7.29 4.68 0.00 2.61 2.67 0.00 0.00 6.85 7.36 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 96 Y 9.15 5.49 0.00 2.93 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 97 T 9.00 5.19 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 1.20 0.00 0.00 98 Y 8.44 5.35 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 99 G 9.57 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 0.00 0.00 0.00 100 V 8.25 5.27 2.22 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 0.87 0.00 0.00 1.16 0.00 0.00 101 T 9.45 5.13 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 1.31 0.00 0.00 102 S 9.85 5.42 0.00 4.17 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 0.00 103 T 8.42 4.49 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 1.20 0.00 0.00 104 L 8.18 3.99 0.00 1.59 1.69 0.91 0.49 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 0.00 105 K 8.27 4.46 0.00 1.81 1.63 0.00 1.53 0.00 0.00 1.72 0.00 0.00 2.77 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.29 1.12 7.81 106 G 9.29 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 0.00 107 F 8.43 4.96 0.00 2.97 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 0.00 108 N 8.22 4.66 0.00 2.76 2.91 0.00 0.00 6.71 7.60 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 0.00 109 V 6.88 4.47 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 1.09 0.00 0.00 0.98 0.00 0.00 110 P 0.00 5.00 0.00 2.34 2.68 0.00 3.82 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.22 0.00 111 M 9.99 5.37 0.00 1.86 2.06 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 2.80 2.32 0.00 112 N 8.97 5.27 0.00 2.59 2.65 0.00 0.00 7.15 7.17 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 0.00 113 L 8.66 5.08 0.00 1.80 1.62 0.97 0.78 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 0.00 114 K 9.10 4.82 0.00 1.64 1.79 0.00 1.19 0.00 0.00 1.53 0.00 0.00 2.75 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.20 1.25 7.81 115 C 8.38 5.35 0.00 2.67 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 0.00 116 S 8.79 4.02 0.00 4.02 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 0.00 117 S 8.12 4.60 0.00 3.92 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 0.00 118 G 7.41 4.35 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 0.00 119 D 8.33 4.79 0.00 2.69 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 0.00 120 A 8.37 4.19 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 0.00 121 L 9.15 4.58 0.00 1.72 1.76 0.06 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 122 P 0.00 4.84 0.00 2.21 2.09 0.00 3.93 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.04 0.00 123 C 9.34 5.00 0.00 3.21 3.22 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 0.00 124 R 8.50 3.66 0.00 1.88 2.03 0.00 3.25 0.00 0.00 3.20 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 125 K 7.43 3.54 0.00 1.47 1.40 0.00 1.66 0.00 0.00 1.53 0.00 0.00 2.92 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.78 1.19 7.81 126 A 7.19 3.86 1.11 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 0.00 127 G 8.73 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 0.00 0.00 0.00 128 C 8.15 4.16 0.00 3.07 3.35 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 0.00 129 D 7.52 3.69 0.00 2.71 2.59 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 0.00 130 V 7.99 3.67 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 0.81 0.00 0.00 0.85 0.00 0.00 131 V 7.12 4.49 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 0.74 0.00 0.00 0.94 0.00 0.00 132 Q 8.48 4.47 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.94 0.00 0.00 0.00 0.00 0.00 2.40 2.35 0.00 133 P 0.00 4.58 0.00 2.18 2.09 0.00 3.78 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 1.96 1.95 0.00 134 Y 9.08 4.69 0.00 3.22 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 0.00 135 A 7.81 4.74 1.07 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 0.00 136 K 8.11 4.55 0.00 0.91 1.34 0.00 1.55 0.00 0.00 1.55 0.00 0.00 2.77 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.05 1.34 7.81 137 S 8.31 5.07 0.00 3.81 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 0.00 138 C 9.51 5.01 0.00 3.40 3.27 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 0.00 139 S 8.75 4.87 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 0.00 140 A 8.01 4.74 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 0.00 141 A 8.85 4.16 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 0.00 142 G 7.68 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 0.00 143 S 8.15 4.57 0.00 3.99 3.97 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 0.00 144 R 8.92 4.62 0.00 1.66 1.74 0.00 3.09 0.00 0.00 3.14 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.57 0.00 145 L 8.66 4.55 0.00 1.25 1.18 0.14 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 146 Q 9.02 4.83 0.00 1.88 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.78 0.00 0.00 0.00 0.00 0.00 2.13 2.21 0.00 147 I 8.55 4.68 1.66 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 0.95 0.81 0.57 0.00 0.00 148 V 8.62 4.63 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 1.02 0.00 0.00 0.85 0.00 0.00 149 F 9.07 4.93 0.00 2.96 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 0.00 150 C 8.66 4.09 0.00 3.14 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 0.00 151 P 0.00 4.42 0.00 2.19 2.03 0.00 3.87 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 2.03 2.00 0.00