NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.5331 8.3044 120.2866 55.2830 33.9296 173.9608 3 V 4.2240 8.0863 121.6732 59.8916 33.7991 172.8096 4 W 4.6839 9.1475 135.0000 57.4055 31.6533 174.8768 5 T 4.1865 8.2830 124.0730 61.4399 66.9892 172.6258 6 P 4.5234 0.0000 0.0000 63.3017 32.2615 175.6618 7 V 4.1140 7.2761 120.0034 62.5554 32.8406 175.1895 8 N 4.2138 8.7021 125.0214 54.9397 36.0702 173.3901 9 N 5.0281 7.6407 108.9045 52.9457 40.0761 174.1662 10 K 4.0925 8.1346 116.2271 56.4985 32.7589 176.6915 11 M 4.9655 8.3534 121.2738 53.9590 35.2628 175.4301 12 F 4.6090 8.3362 116.5063 57.2369 41.1707 176.1952 13 E 3.4797 8.3576 122.5660 57.1977 28.0155 175.5297 14 T 3.8722 8.3479 122.0103 66.5353 68.6999 174.1738 15 F 4.5502 9.1441 124.2653 57.5840 36.4119 176.1896 16 S 4.5173 8.0835 114.4606 60.0408 63.2260 174.4921 17 Y 4.3400 8.2622 117.4031 58.3246 38.2491 175.2306 18 L 4.6577 7.4843 120.2688 52.3514 43.3608 174.6981 19 P 4.4285 0.0000 0.0000 61.9000 31.8305 174.8822 20 P 4.2781 0.0000 0.0000 62.9357 31.7203 176.5210 21 L 4.0160 8.3467 123.0201 54.7647 42.2492 177.8731 22 T 4.2448 8.1776 113.6784 61.1700 71.1448 175.3086 23 D 4.3605 8.6123 121.3141 57.7473 40.7537 178.9058 24 E 3.9333 8.0792 119.2081 59.2679 29.8514 178.7636 25 Q 3.9143 7.9176 117.9877 58.7308 28.7224 178.5705 26 I 3.7152 8.0783 120.9796 64.4812 37.1535 178.1042 27 A 4.0285 8.2227 121.3658 55.4015 18.2193 179.5153 28 A 3.9580 8.0616 119.0433 55.4184 18.4199 179.9574 29 Q 4.1212 7.9984 116.2496 59.0968 28.8103 179.0174 30 V 3.7363 8.1977 119.4067 66.1969 31.5900 177.7355 31 D 4.4364 8.5221 118.9092 57.5530 40.4845 178.2548 32 Y 4.1967 8.0109 119.5545 60.6373 38.9043 177.9147 33 I 3.9337 7.9381 120.7546 64.5960 37.3070 178.5535 34 V 3.5099 7.8179 118.5174 66.0439 31.2008 177.8198 35 A 3.9247 8.1375 119.4846 54.6821 18.2192 178.3565 36 N 4.0870 7.1078 112.3678 52.1275 38.7974 175.8019 37 G 3.7608 7.2769 108.3014 45.9931 0.0000 173.9725 38 W 4.9772 7.4486 118.6087 56.0076 30.7523 176.3544 39 I 4.3577 9.0116 123.3492 59.5877 37.7797 174.0339 40 P 4.8731 0.0000 0.0000 62.9413 32.7384 175.1852 41 C 4.9718 8.6691 121.1632 58.4740 35.5425 172.4902 42 L 5.3551 8.7295 123.6361 53.2460 44.5918 175.1820 43 E 5.6237 9.0333 120.4387 55.1408 34.3308 174.4365 44 F 5.5706 9.1071 115.4523 56.2896 41.9664 172.8633 45 A 4.4831 8.2621 120.0239 50.3972 22.6725 176.3067 46 E 4.3187 8.5862 118.7360 55.6490 30.6406 177.7050 47 A 4.2687 8.7200 122.7467 55.7646 18.4258 179.1489 48 D 4.5332 8.1658 113.8264 56.5516 41.0778 177.2306 49 K 4.5898 7.8981 116.8793 56.0645 32.3951 176.9222 50 A 3.9167 7.8628 123.9636 53.8548 19.0486 178.0785 51 Y 4.7050 7.4493 111.6105 55.4424 40.2419 175.9738 52 V 3.8323 8.4348 122.3876 62.6609 31.6269 175.4518 53 S 4.7938 9.0467 117.0233 57.2194 66.3517 173.7853 54 N 5.3000 8.5287 114.0599 52.5113 39.7312 176.3471 55 E 3.9829 8.2974 119.6585 59.6830 29.5161 179.0222 56 S 4.0731 8.7766 115.3731 60.3993 62.8909 175.7970 57 A 2.5800 7.4751 123.1905 53.2011 17.7822 178.9788 58 I 3.6115 7.0404 116.8052 63.3310 38.0549 176.9920 59 R 4.3372 7.3406 116.4803 55.4691 30.6227 176.1062 60 F 5.0795 7.1519 118.1966 55.8684 41.2892 177.7287 61 G 3.9983 8.2697 116.2435 46.2256 0.0000 175.3560 62 S 4.6124 8.4362 114.0250 58.5758 62.0847 174.4875 63 V 4.4265 7.2872 107.3897 61.1761 33.0875 177.5011 64 S 4.5568 8.1976 114.1306 59.1164 63.5417 173.4883 65 C 4.0302 8.0874 119.4190 61.7040 27.9982 173.0922 66 L 3.6267 8.4447 123.0171 55.5790 39.0668 173.1463 67 Y 4.3741 7.6317 119.2952 56.0484 39.8174 174.5946 68 Y 4.8586 7.2030 123.4348 56.2359 42.2563 174.8060 69 D 4.4737 8.8290 123.6262 55.4863 41.6554 176.7848 70 N 4.7729 8.8992 117.0359 54.2934 35.8761 176.0934 71 R 3.9318 7.9955 118.6565 59.3054 30.3877 177.1300 72 Y 4.3393 7.6631 114.7868 58.0458 38.2394 175.4887 73 W 5.0566 8.6743 124.9142 55.5571 32.4928 174.6535 74 T 4.3397 8.1312 117.1390 62.5094 69.5732 174.5795 75 M 4.4888 8.5141 126.6573 55.2729 33.1633 175.1871 76 W 4.7842 9.4702 135.0000 56.4134 31.2118 176.7539 77 K 3.3228 8.4542 128.6702 57.7726 30.6422 176.9685 78 L 4.9034 8.1593 125.7812 52.6682 44.7378 174.0796 79 P 4.3455 0.0000 0.0000 63.4109 32.3372 177.5493 80 M 4.3131 8.7019 123.2003 53.6955 30.4578 175.8616 81 F 4.4846 7.3737 118.2716 58.9578 40.0012 176.5395 82 G 3.9886 9.1517 112.6908 45.5388 0.0000 172.9928 83 C 4.2887 7.9147 120.6874 59.6008 31.7891 173.2326 84 R 4.5491 8.6412 123.8920 55.5124 31.1963 174.5137 85 D 4.7829 7.8667 118.3743 51.1398 42.7067 174.3500 86 P 4.3475 0.0000 0.0000 66.2783 31.0929 178.1691 87 M 4.1171 8.2928 118.3142 57.9826 31.9125 178.3651 88 Q 3.9921 7.9265 120.0116 59.0936 29.2390 178.5455 89 V 3.6246 7.7286 118.7490 66.0884 31.8229 177.8152 90 L 4.0449 8.1028 118.7565 57.9696 41.4334 179.8177 91 R 4.0181 8.2359 117.9918 59.0949 29.8739 178.9174 92 E 4.1673 8.1656 118.3813 59.0852 29.4695 179.1564 93 I 3.5017 7.7424 120.0420 64.3392 37.2364 178.3098 94 V 3.4754 7.5755 118.3659 66.1539 31.4201 177.8867 95 A 3.9666 7.9700 120.2389 55.1426 18.1790 179.2605 96 C 2.0000 7.6461 117.6289 62.0791 31.3513 176.0092 97 T 3.7194 7.5143 111.1396 64.2589 67.9805 176.4469 98 K 3.8192 7.6599 121.9568 59.3427 32.3153 178.4147 99 A 3.9718 7.4883 119.7643 53.5436 19.9379 177.6684 100 F 4.7323 7.8133 115.4101 55.1567 39.1240 174.0269 101 P 4.4590 0.0000 0.0000 64.3010 31.9297 177.8927 102 D 4.6383 8.0619 116.7194 53.9024 41.1230 175.5319 103 A 4.7590 7.3837 120.8745 50.5310 21.2270 177.0715 104 Y 4.2330 8.4900 117.6060 57.7897 39.4074 175.2302 105 V 5.2098 9.0704 123.6916 61.1002 35.1907 174.3205 106 R 5.0056 9.3610 123.5602 54.2814 33.0343 173.8510 107 L 4.8147 8.1442 123.2212 53.8434 44.0988 175.6601 108 V 4.8049 8.6100 118.0664 59.6456 36.5924 174.0155 109 A 4.8892 8.0531 121.1629 50.7286 22.9359 175.2445 110 F 5.2498 9.1097 119.3403 55.7158 42.6896 174.1022 111 D 5.4150 8.7486 122.4527 52.7171 42.4992 176.5261 112 N 4.7741 9.1687 122.7668 53.9858 38.4103 176.2369 113 Q 4.2204 8.7624 118.9007 58.8714 29.1403 177.6681 114 K 3.9941 8.2635 115.0809 57.2223 32.9191 176.6392 115 Q 3.5132 7.9380 118.6208 55.8493 26.9732 172.5801 116 V 4.4759 7.7063 117.1850 60.1665 34.9980 173.9345 117 Q 4.4603 8.7519 123.4313 56.5116 29.2686 175.4905 118 I 4.1562 8.1467 125.4044 61.4208 39.5840 174.4838 119 M 4.5804 6.7152 117.4637 54.4589 34.3249 173.6643 120 G 4.7610 8.2380 105.9280 47.2467 0.0000 172.3292 121 F 4.9591 7.1178 114.7133 55.4340 40.9545 172.7035 122 L 4.3379 8.9010 122.7771 55.5198 41.9357 176.7382 123 V 4.4852 8.9016 118.7123 61.7817 34.1755 175.9453 124 Q 4.5701 7.8512 121.0851 54.3203 32.4210 173.4817 125 R 4.3210 8.1587 122.1796 52.9047 32.4124 173.8787 126 P 4.1619 0.0000 0.0000 62.8896 31.6157 177.5232 127 K 4.1217 8.4249 119.4911 58.9595 32.1507 178.0834 128 T 4.1057 7.7207 107.1063 62.0565 69.4189 174.4912 129 A 4.1253 7.7041 125.7096 53.3052 18.2902 177.1682 130 R 4.6535 8.8399 121.0113 56.3592 30.8206 176.3217 131 D 5.0400 8.3973 116.3200 52.6758 39.8562 174.9961 132 F 5.3333 8.0809 112.8875 55.4897 41.0324 173.7201 133 Q 4.3907 8.3447 119.9295 52.9468 31.3293 174.2200 134 P 4.4292 0.0000 0.0000 62.3435 32.0713 177.2046 135 A 3.9661 8.6649 123.3916 55.1681 18.3598 178.1303 136 N 4.7778 8.0326 110.7279 52.8973 37.5405 175.4500 137 K 4.4817 7.9810 116.1124 56.2708 33.7791 177.2909 138 R 3.7409 7.7250 119.6453 57.8572 30.9186 176.4477 139 S 5.1035 7.6799 111.7347 56.3007 66.0930 174.8129 140 V 4.0828 8.6448 114.3810 61.6674 31.8535 175.5080 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 M 8.30 4.53 0.00 1.98 2.16 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.58 0.00 3 V 8.09 4.22 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 1.01 0.00 0.00 0.97 0.00 0.00 4 W 9.15 4.68 0.00 3.48 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 5 T 8.28 4.19 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 0.96 0.00 0.00 6 P 0.00 4.52 0.00 2.23 2.19 0.00 3.78 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 1.96 1.96 0.00 7 V 7.28 4.11 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 0.78 0.00 0.00 0.91 0.00 0.00 8 N 8.70 4.21 0.00 2.79 2.79 0.00 0.00 6.80 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 9 N 7.64 5.03 0.00 2.63 2.70 0.00 0.00 7.30 6.68 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 10 K 8.13 4.09 0.00 2.03 1.62 0.00 0.77 0.00 0.00 1.35 0.00 0.00 2.13 0.00 0.00 2.26 0.00 0.00 0.00 0.00 1.33 1.45 7.81 11 M 8.35 4.97 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.67 0.00 12 F 8.34 4.61 0.00 3.16 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 13 E 8.36 3.48 0.00 2.14 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.14 0.00 14 T 8.35 3.87 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 0.17 0.00 0.00 15 F 9.14 4.55 0.00 3.26 3.15 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 16 S 8.08 4.52 0.00 4.17 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 0.00 17 Y 8.26 4.34 0.00 3.06 3.21 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 18 L 7.48 4.66 0.00 1.76 1.60 0.82 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.43 0.00 2.03 2.01 0.00 3.71 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 2.04 2.14 0.00 20 P 0.00 4.28 0.00 2.05 2.04 0.00 3.71 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 2.08 2.20 0.00 21 L 8.35 4.02 0.00 1.59 1.49 0.25 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 22 T 8.18 4.24 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 1.19 0.00 0.00 23 D 8.61 4.36 0.00 2.70 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 E 8.08 3.93 0.00 2.02 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 25 Q 7.92 3.91 0.00 2.32 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.58 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 26 I 8.08 3.72 2.07 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.75 1.07 0.00 0.00 27 A 8.22 4.03 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 28 A 8.06 3.96 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 29 Q 8.00 4.12 0.00 2.54 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.75 0.00 0.00 0.00 0.00 0.00 2.39 1.98 0.00 30 V 8.20 3.74 2.29 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 1.15 0.00 0.00 1.10 0.00 0.00 31 D 8.52 4.44 0.00 2.98 2.76 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 0.00 0.00 0.00 0.00 32 Y 8.01 4.20 0.00 3.23 3.36 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 33 I 7.94 3.93 2.14 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.35 1.08 0.00 0.00 34 V 7.82 3.51 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 1.02 0.00 0.00 1.01 0.00 0.00 35 A 8.14 3.92 1.22 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 0.00 0.00 36 N 7.11 4.09 0.00 1.44 1.42 0.00 0.00 7.04 7.54 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 37 G 7.28 3.76 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 W 7.45 4.98 0.00 3.36 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 39 I 9.01 4.36 2.11 0.00 0.00 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 1.48 0.80 0.68 0.00 0.00 40 P 0.00 4.87 0.00 2.09 1.98 0.00 3.80 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.13 0.00 41 C 8.67 4.97 0.00 3.08 2.66 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 42 L 8.73 5.36 0.00 1.85 1.61 0.87 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 43 E 9.03 5.62 0.00 2.07 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 2.37 2.33 0.00 44 F 9.11 5.57 0.00 3.07 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 45 A 8.26 4.48 -0.09 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 0.00 0.00 46 E 8.59 4.32 0.00 2.18 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 2.30 2.27 0.00 47 A 8.72 4.27 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.17 4.53 0.00 2.70 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 K 7.90 4.59 0.00 1.52 1.70 0.00 1.71 0.00 0.00 1.83 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.34 1.44 7.81 50 A 7.86 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 Y 7.45 4.70 0.00 2.91 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 V 8.43 3.83 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 0.54 0.00 0.00 0.77 0.00 0.00 53 S 9.05 4.79 0.00 4.02 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 N 8.53 5.30 0.00 2.76 2.83 0.00 0.00 6.58 7.66 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 55 E 8.30 3.98 0.00 2.15 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 0.00 2.38 2.37 0.00 56 S 8.78 4.07 0.00 3.95 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 A 7.48 2.58 1.09 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 0.00 0.00 58 I 7.04 3.61 1.79 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.81 0.86 0.00 0.00 59 R 7.34 4.34 0.00 1.94 2.00 0.00 3.19 0.00 0.00 3.22 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.56 0.00 60 F 7.15 5.08 0.00 3.00 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 G 8.27 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.44 4.61 0.00 3.86 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 63 V 7.29 4.43 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 0.66 0.00 0.00 0.48 0.00 0.00 64 S 8.20 4.56 0.00 4.12 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 0.00 65 C 8.09 4.03 0.00 2.97 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 66 L 8.44 3.63 0.00 1.77 1.76 0.94 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 67 Y 7.63 4.37 0.00 2.96 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 68 Y 7.20 4.86 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 69 D 8.83 4.47 0.00 2.79 2.66 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 70 N 8.90 4.77 0.00 3.06 3.24 0.00 0.00 7.00 7.66 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 71 R 8.00 3.93 0.00 1.49 1.68 0.00 3.07 0.00 0.00 3.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.56 0.00 72 Y 7.66 4.34 0.00 3.04 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 73 W 8.67 5.06 0.00 3.10 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 T 8.13 4.34 2.89 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 0.90 0.00 0.00 75 M 8.51 4.49 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.78 0.00 76 W 9.47 4.78 0.00 3.68 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 77 K 8.45 3.32 0.00 1.66 0.97 0.00 1.66 0.00 0.00 1.54 0.00 0.00 2.71 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.82 0.21 7.81 78 L 8.16 4.90 0.00 1.62 1.61 1.01 1.03 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 79 P 0.00 4.35 0.00 0.67 1.85 0.00 3.67 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.16 0.00 80 M 8.70 4.31 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.54 0.00 81 F 7.37 4.48 0.00 3.10 2.98 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 82 G 9.15 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 83 C 7.91 4.29 0.00 3.10 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 84 R 8.64 4.55 0.00 1.80 1.87 0.00 3.22 0.00 0.00 3.16 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.59 0.00 85 D 7.87 4.78 0.00 2.72 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.35 0.00 2.33 2.34 0.00 3.76 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.18 0.00 87 M 8.29 4.12 0.00 2.11 2.29 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.70 0.00 88 Q 7.93 3.99 0.00 2.15 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.82 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 89 V 7.73 3.62 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 0.97 0.00 0.00 90 L 8.10 4.04 0.00 1.89 1.72 0.95 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 91 R 8.24 4.02 0.00 2.05 2.01 0.00 3.14 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 1.66 1.88 0.00 92 E 8.17 4.17 0.00 2.25 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 0.00 2.63 2.66 0.00 93 I 7.74 3.50 1.99 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.04 0.85 0.00 0.00 94 V 7.58 3.48 2.20 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 0.97 0.00 0.00 0.97 0.00 0.00 95 A 7.97 3.97 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 96 C 7.65 2.00 0.00 1.23 2.34 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 97 T 7.51 3.72 4.32 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 1.12 0.00 0.00 98 K 7.66 3.82 0.00 1.79 1.97 0.00 1.76 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.38 1.38 7.81 99 A 7.49 3.97 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 F 7.81 4.73 0.00 2.87 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 P 0.00 4.46 0.00 2.11 2.10 0.00 3.25 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.87 0.00 102 D 8.06 4.64 0.00 2.68 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 0.00 103 A 7.38 4.76 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 0.00 104 Y 8.49 4.23 0.00 2.52 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 0.00 105 V 9.07 5.21 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 1.01 0.00 0.00 0.86 0.00 0.00 106 R 9.36 5.01 0.00 1.85 1.92 0.00 2.35 0.00 0.00 2.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.36 0.00 107 L 8.14 4.81 0.00 1.48 0.75 0.89 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.61 4.80 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 0.41 0.00 0.00 0.44 0.00 0.00 109 A 8.05 4.89 1.19 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 0.00 110 F 9.11 5.25 0.00 2.97 2.87 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 0.00 111 D 8.75 5.41 0.00 2.36 2.42 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 0.00 112 N 9.17 4.77 0.00 2.93 3.05 0.00 0.00 6.30 7.39 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 0.00 113 Q 8.76 4.22 0.00 2.25 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 7.06 0.00 0.00 0.00 0.00 0.00 2.46 2.54 0.00 114 K 8.26 3.99 0.00 1.75 1.87 0.00 2.05 0.00 0.00 1.61 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.46 7.81 115 Q 7.94 3.51 0.00 2.15 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.70 0.00 0.00 0.00 0.00 0.00 2.23 2.31 0.00 116 V 7.71 4.48 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 0.56 0.00 0.00 0.91 0.00 0.00 117 Q 8.75 4.46 0.00 2.19 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.90 0.00 0.00 0.00 0.00 0.00 2.20 1.98 0.00 118 I 8.15 4.16 1.18 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.18 -0.51 0.00 0.00 119 M 6.72 4.58 0.00 2.17 2.25 0.00 0.00 0.00 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.80 0.00 120 G 8.24 4.76 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 F 7.12 4.96 0.00 3.24 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 0.00 122 L 8.90 4.34 0.00 1.63 1.64 0.70 0.41 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 0.00 123 V 8.90 4.49 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 0.63 0.00 0.00 0.91 0.00 0.00 124 Q 7.85 4.57 0.00 1.98 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.83 0.00 0.00 0.00 0.00 0.00 2.26 2.21 0.00 125 R 8.16 4.32 0.00 1.12 1.52 0.00 2.21 0.00 0.00 2.80 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.18 0.00 126 P 0.00 4.16 0.00 2.09 2.13 0.00 2.20 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.58 0.00 127 K 8.42 4.12 0.00 1.74 1.91 0.00 1.70 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.37 7.81 128 T 7.72 4.11 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 1.21 0.00 0.00 129 A 7.70 4.13 1.50 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 0.00 0.00 130 R 8.84 4.65 0.00 1.84 1.95 0.00 3.33 0.00 0.00 3.29 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.56 0.00 131 D 8.40 5.04 0.00 2.88 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 0.00 132 F 8.08 5.33 0.00 3.21 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 0.00 133 Q 8.34 4.39 0.00 1.86 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 7.02 0.00 0.00 0.00 0.00 0.00 2.32 2.02 0.00 134 P 0.00 4.43 0.00 2.17 2.14 0.00 3.48 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.84 0.00 135 A 8.66 3.97 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 0.00 136 N 8.03 4.78 0.00 2.83 2.91 0.00 0.00 5.81 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 0.00 137 K 7.98 4.48 0.00 1.70 1.68 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.28 1.41 7.81 138 R 7.72 3.74 0.00 1.20 0.66 0.00 3.01 0.00 0.00 3.28 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.56 0.00 139 S 7.68 5.10 0.00 3.91 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 0.00 140 V 8.64 4.08 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 0.58 0.00 0.00 0.95 0.00 0.00