NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 18 V 3.9039 7.9127 120.3922 63.3778 32.5979 175.8383 19 T 3.2677 8.4420 113.3013 60.8022 66.5909 171.2320 20 K 4.1869 7.4338 121.4487 54.5629 31.6624 174.4566 21 T 3.6782 7.3279 113.9745 60.7813 68.7280 171.7132 22 Q 4.4653 7.9660 120.4637 55.7895 29.4123 177.0333 23 K 3.8621 7.4653 116.6339 57.2861 32.1004 178.5538 24 K 3.8362 7.9453 111.0947 53.2206 35.7273 175.0511 25 G 3.8198 8.0946 107.3565 45.6776 0.0000 172.4127 26 D 4.8123 7.7280 116.6109 52.0164 41.8916 177.1550 27 K 4.5049 8.0525 118.7598 55.8762 32.8258 178.6544 28 K 3.5046 8.7444 126.0762 55.6901 34.7522 178.1142 29 R 3.7439 8.4005 107.3682 57.1300 26.4216 175.4517 30 K 4.3283 7.7572 119.4856 57.5399 34.9050 178.0311 31 K 4.6232 7.7047 117.9434 56.3036 37.2927 177.1753 32 S 5.6256 10.2065 121.8467 57.6704 61.7662 171.1275 33 R 3.7347 7.6684 127.6664 55.6116 28.3149 174.7099 34 K 4.4274 8.3498 124.6428 54.8212 33.4558 176.8187 35 E 4.4180 8.3926 123.5200 55.7368 30.8709 175.3393 36 S 4.5001 7.6371 112.3557 56.9625 65.1812 175.3883 37 Y 4.6577 8.1405 118.7056 58.5121 37.3999 177.4656 38 S 4.2226 8.1690 117.0171 61.9450 62.3375 176.6423 39 I 3.7581 7.4624 114.5621 63.8850 37.2814 177.4895 40 Y 4.2830 7.4411 118.3236 60.7497 37.9827 177.6952 41 V 3.7350 8.8183 119.7429 66.1569 31.6377 177.4934 42 Y 3.8569 8.5680 119.6704 60.4601 38.7184 177.9223 43 K 3.8903 8.4135 119.7081 59.7669 32.1325 179.3728 44 V 3.9008 7.8044 119.5238 65.2801 31.2721 177.8614 45 L 3.8848 7.8937 120.1308 58.0553 42.0009 179.1253 46 K 3.9149 7.7976 118.3361 59.3648 31.4378 179.4202 47 Q 4.0702 8.0277 118.5313 58.6541 28.4230 178.5404 48 V 4.0215 7.3591 111.6925 62.1450 33.4050 176.6082 49 H 4.9476 8.4134 116.0858 52.8091 29.9952 171.5914 50 P 4.3384 0.0000 0.0000 64.2085 31.6218 177.0587 51 D 4.9496 8.0482 114.9927 54.0463 41.2928 175.4789 52 T 4.5613 7.9614 116.0206 61.7154 70.5337 174.1628 53 G 4.3541 8.3947 113.8281 43.7042 0.0000 171.8738 54 I 4.6755 7.9994 117.7533 58.0589 41.1177 175.5915 55 S 4.4101 8.5267 122.2406 58.0542 65.0826 175.5220 56 S 4.0997 8.7132 118.8208 61.7492 62.4943 176.9895 57 K 3.9876 8.0428 121.4823 59.1193 31.8325 178.9441 58 A 4.0712 8.2883 121.4999 55.0606 18.2939 179.3802 59 M 4.1206 8.5155 117.4492 58.5471 32.4322 178.3274 60 G 3.8273 8.2694 106.2841 48.3220 0.0000 175.5836 61 I 3.8208 7.8003 122.7394 64.1794 37.0995 178.5436 62 M 4.2178 8.4519 119.9069 58.4337 31.8529 178.5354 63 N 4.5251 8.8680 117.1664 56.4713 38.6785 177.6538 64 S 4.2012 8.0482 116.1913 61.4042 62.8498 176.4151 65 F 4.2596 8.4727 123.4331 61.4094 39.0972 177.3925 66 V 3.0553 7.7592 117.7392 65.8085 31.1879 177.7316 67 N 4.3039 7.9921 115.9522 56.2750 38.4307 176.6248 68 D 4.3347 8.4180 119.7436 57.7659 41.3586 178.5748 69 I 3.5868 8.1445 120.5452 63.9413 36.8926 178.0500 70 F 3.8606 8.2879 121.9593 61.6226 39.0909 177.2428 71 E 4.0982 8.6619 118.0125 59.2554 29.1920 179.6049 72 R 3.8770 8.0677 118.3003 59.2122 30.0662 179.2078 73 I 3.5604 7.6788 119.2197 64.2502 37.1659 178.2296 74 A 3.7953 7.7660 121.8930 54.9995 18.1221 179.7207 75 G 3.4849 8.1843 104.3308 48.0293 0.0000 175.2798 76 E 3.8468 8.2282 122.3364 58.7277 29.6187 178.7642 77 A 3.8529 8.5591 121.1035 55.1825 18.5064 179.5061 78 S 3.8762 8.3366 111.9150 61.4673 62.4378 176.7600 79 R 3.5229 7.8582 120.6500 58.8894 29.6286 178.3661 80 L 3.6589 7.6999 120.1717 58.4190 41.9070 179.0975 81 A 4.0428 7.7451 120.2279 55.2411 18.1400 179.4465 82 H 4.1769 7.7741 114.5382 59.3616 28.6470 177.5220 83 Y 4.4674 7.9853 117.4133 60.4800 37.6267 177.7167 84 N 4.9061 7.4251 113.8384 51.5613 39.5689 174.5461 85 K 3.8559 8.1156 118.3710 57.6379 30.4354 174.9477 86 R 4.6053 8.0652 117.2043 54.7356 32.0039 175.3165 87 S 4.6716 8.5811 117.6247 58.0818 63.5716 173.5242 88 T 4.4755 7.4005 114.4157 60.5194 70.0035 172.9777 89 I 4.0695 8.3326 129.5182 60.4695 37.5782 175.1240 90 T 4.6061 8.9152 117.1747 59.2529 71.4072 175.1578 91 S 4.0871 8.5064 115.2931 61.8124 62.4929 176.4047 92 R 3.8869 7.8532 121.7806 59.1459 29.7206 178.3896 93 E 3.9068 8.0176 117.9445 59.4938 29.5010 178.9944 94 I 3.5673 7.6856 119.8079 64.3791 37.1050 178.1786 95 Q 3.9113 8.4175 120.8460 59.5494 28.9234 178.6234 96 T 3.9681 8.0127 110.2727 64.2542 68.7580 176.4674 97 A 3.9127 8.1476 124.2627 55.1571 18.3971 179.6800 98 V 3.4987 8.0220 117.0202 66.2463 31.3118 178.5189 99 R 3.9643 7.7065 117.0314 59.1031 29.9598 178.6991 100 L 4.1301 8.1200 118.5944 57.5553 41.6898 178.8281 101 L 4.1197 8.1618 119.7034 56.0592 42.5573 176.7573 102 L 4.6768 7.2153 117.7460 52.2421 43.6502 174.4937 103 P 4.4912 0.0000 0.0000 62.7755 34.4626 181.2372 104 G 3.3372 8.4616 105.0282 45.1746 0.0000 177.6743 105 E 4.0523 9.2245 129.8354 58.9968 29.9511 177.4922 106 L 4.0039 7.9564 120.0807 57.9347 42.1515 178.7180 107 A 3.9846 8.0570 120.7884 54.9998 18.3542 179.4812 108 K 3.7910 7.7847 116.7049 60.2945 32.1401 179.3069 109 H 4.1722 8.0995 115.3880 58.6596 28.5817 177.8764 110 A 3.9820 8.1533 122.7348 55.0281 18.2535 179.7428 111 V 3.4857 8.1322 117.2165 66.3314 31.6176 178.2425 112 S 4.1431 8.1554 112.7611 61.4604 62.3508 175.8932 113 E 4.2064 8.7517 121.6894 58.7473 29.2218 179.5703 114 G 3.5417 8.4817 106.6600 48.0339 0.0000 175.9082 115 T 3.8741 8.3777 118.9197 66.2322 68.4774 176.5509 116 K 3.9403 8.1389 121.2272 59.5374 32.1507 178.7722 117 A 4.0933 7.9910 120.7728 54.8739 18.1995 179.8738 118 V 3.5860 7.8238 117.0362 66.3945 31.6248 178.3802 119 T 3.8786 8.0298 115.5358 66.5764 68.0913 176.5681 120 K 3.9683 7.9430 120.2565 59.6582 32.3333 177.8600 121 Y 4.1444 8.1797 119.3089 60.7547 38.8663 177.7415 122 T 4.1071 8.3593 110.3536 63.4917 69.0672 176.2092 123 S 4.4112 7.8121 115.2875 58.5443 63.3301 173.5644 124 S 4.6329 6.7664 117.0441 56.4672 64.4683 173.6083 125 K 4.0626 8.2823 123.7226 56.5373 31.9549 176.3452 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 18 V 7.91 3.90 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 0.93 0.00 0.00 0.93 0.00 0.00 19 T 8.44 3.27 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 1.21 0.00 0.00 20 K 7.43 4.19 0.00 1.92 1.83 0.00 1.64 0.00 0.00 1.75 0.00 0.00 3.04 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.37 7.81 21 T 7.33 3.68 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 1.21 0.00 0.00 22 Q 7.97 4.47 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.40 5.98 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 23 K 7.47 3.86 0.00 1.92 1.91 0.00 1.84 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.30 1.41 7.81 24 K 7.95 3.84 0.00 1.95 1.82 0.00 1.97 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.43 7.81 25 G 8.09 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 0.00 0.00 0.00 26 D 7.73 4.81 0.00 2.79 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 K 8.05 4.50 0.00 1.69 1.75 0.00 1.76 0.00 0.00 1.75 0.00 0.00 3.27 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.32 1.43 7.81 28 K 8.74 3.50 0.00 2.07 1.62 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.36 1.39 7.81 29 R 8.40 3.74 0.00 1.96 1.99 0.00 3.19 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.79 0.00 30 K 7.76 4.33 0.00 1.73 1.81 0.00 1.77 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.41 1.36 7.81 31 K 7.70 4.62 0.00 1.80 1.47 0.00 1.71 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.30 1.41 7.81 32 S 10.21 5.63 0.00 3.95 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 R 7.67 3.73 0.00 1.97 1.97 0.00 3.26 0.00 0.00 3.21 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.61 0.00 34 K 8.35 4.43 0.00 1.76 1.70 0.00 1.78 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.35 1.42 7.81 35 E 8.39 4.42 0.00 1.83 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.23 0.00 36 S 7.64 4.50 0.00 4.04 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 37 Y 8.14 4.66 0.00 3.35 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 38 S 8.17 4.22 0.00 3.94 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 39 I 7.46 3.76 1.65 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 -0.36 0.73 0.00 0.00 40 Y 7.44 4.28 0.00 3.35 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 41 V 8.82 3.73 2.36 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 1.10 0.00 0.00 1.14 0.00 0.00 42 Y 8.57 3.86 0.00 3.29 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 43 K 8.41 3.89 0.00 2.05 1.91 0.00 1.90 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.54 1.80 7.81 44 V 7.80 3.90 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 1.02 0.00 0.00 45 L 7.89 3.88 0.00 1.73 1.51 0.91 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 46 K 7.80 3.91 0.00 1.80 1.75 0.00 1.60 0.00 0.00 1.59 0.00 0.00 2.76 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.95 1.41 7.81 47 Q 8.03 4.07 0.00 2.24 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.71 0.00 0.00 0.00 0.00 0.00 2.37 2.59 0.00 48 V 7.36 4.02 1.89 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 0.69 0.00 0.00 0.82 0.00 0.00 49 H 8.41 4.95 0.00 3.06 3.09 0.00 5.65 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 P 0.00 4.34 0.00 2.03 2.14 0.00 3.70 0.00 0.00 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.22 0.00 51 D 8.05 4.95 0.00 2.64 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 T 7.96 4.56 4.34 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 1.19 0.00 0.00 53 G 8.39 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 54 I 8.00 4.68 1.96 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.03 1.13 0.00 0.00 55 S 8.53 4.41 0.00 4.10 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 56 S 8.71 4.10 0.00 4.07 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 57 K 8.04 3.99 0.00 1.83 1.90 0.00 1.67 0.00 0.00 1.83 0.00 0.00 2.97 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.54 1.51 7.81 58 A 8.29 4.07 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 59 M 8.52 4.12 0.00 2.30 2.13 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.65 0.00 60 G 8.27 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 61 I 7.80 3.82 2.02 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 1.55 0.66 0.92 0.00 0.00 62 M 8.45 4.22 0.00 2.12 2.31 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.92 0.00 63 N 8.87 4.53 0.00 3.11 2.96 0.00 0.00 6.98 7.18 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 64 S 8.05 4.20 0.00 4.17 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 F 8.47 4.26 0.00 3.10 3.31 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 66 V 7.76 3.06 1.70 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 -0.11 0.00 0.00 0.95 0.00 0.00 67 N 7.99 4.30 0.00 2.99 2.88 0.00 0.00 6.67 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 68 D 8.42 4.33 0.00 2.87 2.85 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 69 I 8.14 3.59 1.40 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.31 0.73 0.00 0.00 70 F 8.29 3.86 0.00 3.03 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 71 E 8.66 4.10 0.00 2.11 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 2.55 2.78 0.00 72 R 8.07 3.88 0.00 1.94 1.93 0.00 3.11 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.97 0.00 73 I 7.68 3.56 1.61 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.83 0.74 0.00 0.00 74 A 7.77 3.80 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 G 8.18 3.48 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 0.00 76 E 8.23 3.85 0.00 2.20 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.34 0.00 77 A 8.56 3.85 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 78 S 8.34 3.88 0.00 3.85 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 79 R 7.86 3.52 0.00 1.73 1.13 0.00 3.22 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.52 0.00 80 L 7.70 3.66 0.00 1.73 1.72 0.96 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 81 A 7.75 4.04 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 82 H 7.77 4.18 0.00 3.25 3.33 0.00 5.66 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 Y 7.99 4.47 0.00 3.00 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 84 N 7.43 4.91 0.00 2.73 2.82 0.00 0.00 7.12 7.49 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 85 K 8.12 3.86 0.00 1.87 1.88 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.39 7.81 86 R 8.07 4.61 0.00 1.81 1.75 0.00 3.29 0.00 0.00 3.45 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 87 S 8.58 4.67 0.00 4.00 3.93 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 0.00 0.00 0.00 0.00 88 T 7.40 4.48 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 1.20 0.00 0.00 89 I 8.33 4.07 1.81 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 1.37 0.60 0.82 0.00 0.00 90 T 8.92 4.61 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 91 S 8.51 4.09 0.00 4.03 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 92 R 7.85 3.89 0.00 1.89 1.94 0.00 3.08 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 93 E 8.02 3.91 0.00 2.17 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 2.33 2.40 0.00 94 I 7.69 3.57 1.96 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.89 0.81 0.00 0.00 95 Q 8.42 3.91 0.00 2.16 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 96 T 8.01 3.97 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 97 A 8.15 3.91 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 98 V 8.02 3.50 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 1.00 0.00 0.00 0.92 0.00 0.00 99 R 7.71 3.96 0.00 1.96 1.97 0.00 3.21 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 1.65 1.79 0.00 100 L 8.12 4.13 0.00 1.73 1.73 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 101 L 8.16 4.12 0.00 1.64 1.65 0.90 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 102 L 7.22 4.68 0.00 1.69 1.57 0.92 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 103 P 0.00 4.49 0.00 2.22 2.17 0.00 3.71 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 2.07 1.97 0.00 104 G 8.46 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 0.00 0.00 0.00 105 E 9.22 4.05 0.00 2.02 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 2.42 2.33 0.00 106 L 7.96 4.00 0.00 1.92 1.69 0.94 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 107 A 8.06 3.98 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 0.00 108 K 7.78 3.79 0.00 1.90 1.74 0.00 1.70 0.00 0.00 1.80 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.51 7.81 109 H 8.10 4.17 0.00 3.20 3.36 0.00 5.62 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 A 8.15 3.98 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 V 8.13 3.49 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 0.84 0.00 0.00 0.91 0.00 0.00 112 S 8.16 4.14 0.00 3.92 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 0.00 113 E 8.75 4.21 0.00 2.17 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 2.34 2.34 0.00 114 G 8.48 3.54 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 0.00 0.00 0.00 115 T 8.38 3.87 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 1.21 0.00 0.00 116 K 8.14 3.94 0.00 2.00 2.00 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.47 7.81 117 A 7.99 4.09 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 0.00 118 V 7.82 3.59 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 1.14 0.00 0.00 0.89 0.00 0.00 119 T 8.03 3.88 4.40 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 1.22 0.00 0.00 120 K 7.94 3.97 0.00 1.79 1.89 0.00 1.83 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.46 7.81 121 Y 8.18 4.14 0.00 3.07 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 T 8.36 4.11 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 1.40 0.00 0.00 123 S 7.81 4.41 0.00 4.05 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 0.00 124 S 6.77 4.63 0.00 3.65 3.70 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 0.00 125 K 8.28 4.06 0.00 1.70 1.61 0.00 1.83 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.34 1.34 7.81