NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 4.4297 8.3916 118.1852 56.3792 31.1474 174.5321 2 W 5.1276 8.8044 127.5643 56.1709 33.6843 173.8020 3 T 3.5507 9.2559 122.6096 66.7706 68.8088 174.4255 4 G 2.1717 5.3800 106.2136 44.6518 0.0000 173.2646 5 D 4.5476 7.5943 120.1890 54.1722 42.0621 176.1621 6 A 4.7592 8.2968 123.7118 50.4549 16.3924 176.3734 7 R 4.6719 7.5427 118.8468 53.8597 35.3503 174.5865 8 D 4.2372 8.6375 120.6690 55.0070 41.5962 176.6939 9 G 3.8571 7.6422 108.5408 45.5793 0.0000 171.5878 10 M 6.0185 8.4716 115.1980 54.9090 34.1747 174.1544 11 F 4.8885 8.9346 119.2869 56.0724 42.0764 174.7773 12 S 4.6952 8.8422 119.7370 56.8756 64.9544 173.7383 13 G 3.8793 8.2167 107.1763 46.8848 0.0000 173.2308 14 V 4.4901 8.1743 118.5345 60.9530 34.0611 174.8910 15 V 4.4216 8.2805 128.2485 61.5784 32.9687 174.8213 16 I 4.4315 8.5983 129.7433 61.8676 36.7846 175.5524 17 T 4.7267 9.1893 118.1415 61.7689 71.1158 174.6845 18 Q 4.8939 8.1780 119.8837 54.0253 33.1205 174.2379 19 F 5.1365 8.5633 123.2426 57.0213 42.6398 173.0001 20 H 5.1830 9.4257 125.2065 54.6999 33.5020 171.7215 21 T 4.8601 8.2674 118.1988 60.7193 70.3936 173.1149 22 G 3.7828 7.6075 113.7508 45.8130 0.0000 171.2245 23 Q 5.0614 8.5152 119.5107 54.4079 32.3659 174.7863 24 I 4.5428 8.5372 123.5221 60.6326 41.3638 174.3869 25 D 4.2011 9.6165 125.5198 55.4599 39.4259 173.1242 26 N 4.2909 8.3398 110.8316 53.8167 37.9252 172.7991 27 K 4.5050 7.9141 116.4244 53.1826 34.9520 173.9478 28 P 4.9775 0.0000 0.0000 63.1039 32.6330 174.7685 29 Y 5.6224 8.6396 119.4199 55.5848 42.0676 173.6533 30 F 5.5321 9.5062 114.4642 55.4867 41.9463 172.9615 31 C 5.4422 9.5422 117.1044 55.1377 38.6022 173.1503 32 I 5.0260 8.4805 114.8438 59.0822 40.7934 173.8578 33 E 5.0979 8.8366 123.4562 54.8168 33.2956 174.5456 34 G 4.6028 8.7140 110.8457 45.1845 0.0000 171.5697 35 K 5.2617 8.6874 119.3000 53.8344 35.9427 176.7101 36 Q 4.9109 8.6852 121.0543 54.3445 27.7223 174.6302 37 S 4.0904 8.1258 122.6993 60.1233 62.9758 173.9349 38 A 3.8520 7.8173 121.8571 52.2397 18.1123 178.2782 39 G 3.9760 7.7058 103.9055 45.0016 0.0000 174.4345 40 S 4.2705 7.7765 114.7573 58.4430 63.5679 172.9243 41 S 5.2589 8.5172 116.8673 56.6580 65.3144 172.8179 42 I 4.2044 8.5631 124.9945 59.3007 41.1269 173.8303 43 S 5.4809 8.5566 124.0188 56.1610 65.7729 173.2934 44 A 4.8661 8.1647 122.8409 51.0968 22.6717 175.7080 45 C 5.2955 9.5949 118.7424 55.0978 39.8021 172.9452 46 S 5.4000 8.1530 116.5520 56.7474 65.0507 172.3583 47 M 5.1659 8.7947 125.3524 53.2295 34.2255 174.4098 48 K 3.9138 8.1877 127.9717 57.6753 32.7481 176.4688 49 N 4.5205 8.9013 122.0400 54.2547 36.2002 174.6164 50 S 4.5365 7.4521 112.9454 57.6269 64.2066 174.9341 51 S 4.1986 8.9167 117.4167 61.5210 62.5743 175.8006 52 V 3.7247 7.7388 118.4184 62.4568 32.1291 176.7113 53 W 4.8697 7.8744 119.0290 55.6774 29.3605 178.4304 54 G 3.9127 7.9690 109.2264 47.7382 0.0000 176.3267 55 A 4.1426 8.2268 122.1518 54.4664 18.6613 177.9918 56 S 4.7954 8.1270 109.3786 58.1822 63.8360 175.5271 57 F 4.9154 8.7010 126.2139 61.5673 38.9798 177.3768 58 S 3.9571 8.3239 112.6756 61.1115 63.2275 176.3727 59 T 3.8584 7.9123 119.0066 66.6627 68.2947 176.5150 60 L 4.1773 8.4604 121.2976 57.7517 41.6274 178.9851 61 Y 2.6686 8.1622 119.8029 60.2845 38.6845 177.8049 62 N 4.0195 7.9356 117.2388 56.3784 38.6220 177.2030 63 Q 3.6607 7.9976 120.4988 59.0965 29.1622 178.1678 64 A 4.2537 8.3371 122.2447 55.0626 18.3982 179.4228 65 L 3.8240 7.8159 119.0336 58.0861 42.0358 178.3371 66 Y 3.8886 7.8432 119.5718 60.9601 38.7158 178.4468 67 F 4.6908 8.4397 118.7455 60.6687 38.7604 176.9482 68 Y 4.3626 8.6212 118.9506 61.1182 38.6325 178.2753 69 T 3.8143 7.8611 115.6632 66.8667 68.6874 176.6826 70 T 3.9523 7.5087 110.3231 62.5021 68.8485 175.5808 71 G 3.8370 7.8657 108.2264 45.7200 0.0000 173.3925 72 Q 4.2671 7.6450 116.8234 54.9665 29.6361 174.1836 73 P 4.6156 0.0000 0.0000 62.8669 32.1819 175.9647 74 V 4.4549 8.8911 116.9099 59.5609 36.9611 173.9883 75 R 4.8178 8.8270 122.3275 55.2107 31.9655 174.8977 76 I 4.6516 8.4508 127.2071 60.0083 39.2330 174.2097 77 Y 4.9674 8.8828 126.2888 57.2391 39.2871 174.5858 78 Y 5.2172 8.5792 121.2526 55.1632 42.5782 173.7765 79 E 4.8489 8.7438 120.9538 53.4594 32.1817 173.4058 80 P 5.2287 0.0000 0.0000 63.4464 32.2192 176.8398 81 G 3.8930 8.4557 110.0237 45.8132 0.0000 174.8920 82 V 3.4096 7.3865 119.8487 64.9785 31.6662 176.4352 83 W 4.8603 7.4287 119.5257 56.0953 29.5868 176.2014 84 T 4.4771 8.4919 111.7822 61.5965 70.4900 173.9962 85 Y 4.2721 8.0526 123.4058 57.1263 39.4145 174.1170 86 P 4.1522 0.0000 0.0000 65.3607 31.5681 176.8214 87 P 4.0883 0.0000 0.0000 65.2452 31.1322 178.3670 88 F 3.9655 7.9970 119.0509 61.3721 39.1680 177.1965 89 V 3.8835 7.7085 116.4511 65.9014 31.3854 177.5992 90 K 4.0276 8.0967 118.4749 59.4883 32.1626 178.4297 91 A 4.1340 7.8914 119.8314 53.1759 18.5058 177.4824 92 L 4.2271 7.7458 112.6661 54.2821 43.5197 177.0209 93 T 4.2559 7.9008 113.1645 61.9902 70.8108 172.3997 94 S 4.7473 8.2996 118.9564 59.9221 64.9260 173.6344 95 N 4.9612 8.2922 120.1349 53.2426 39.3499 174.2326 96 A 4.9954 8.6606 126.6733 51.4022 20.0972 176.0177 97 L 4.5693 8.9101 125.3846 54.8894 42.3624 176.6413 98 V 3.9536 9.1427 124.7729 61.4949 33.4573 175.0950 99 G 4.1632 7.5280 107.5729 46.8366 0.0000 171.6325 100 L 5.7812 8.4711 118.7316 53.5108 46.0246 176.1070 101 S 5.1177 9.0113 117.0733 56.9384 67.7979 173.9645 102 T 4.2372 8.9009 113.1301 62.1009 70.0395 173.6577 103 C 5.5085 8.5588 119.5909 55.6980 43.0883 174.1214 104 T 4.0825 8.9693 112.4582 62.9452 69.1910 174.3351 105 T 4.7337 7.3463 110.4992 59.3523 72.0344 174.2947 106 S 3.9297 8.6926 115.2496 60.4438 63.0417 174.9438 107 T 4.3927 7.3758 109.2616 61.3483 70.6290 173.8741 108 E 4.6137 8.1902 122.5351 54.7387 30.8240 174.3888 109 C 5.3524 8.3687 119.8682 54.6455 44.5091 173.5101 110 F 4.5824 8.8366 124.9347 59.1881 39.3981 173.5938 111 G 3.4851 8.5427 113.7488 43.3022 0.0000 171.2906 112 P 4.5049 0.0000 0.0000 62.5289 32.0416 175.4096 113 D 4.6143 8.3362 119.0965 54.1473 42.1747 176.4541 114 R 4.4786 8.5745 122.5645 54.5652 31.7947 173.9767 115 K 4.4036 8.0565 128.3914 54.2297 35.8853 176.0645 116 K 4.2740 8.6791 127.2874 56.7621 32.1962 176.2084 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 E 8.39 4.43 0.00 1.89 1.80 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 1.55 1.47 0.00 2 W 8.80 5.13 0.00 3.38 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 3 T 9.26 3.55 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 0.32 0.00 0.00 4 G 5.38 2.17 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 0.00 5 D 7.59 4.55 0.00 2.68 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 6 A 8.30 4.76 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 7 R 7.54 4.67 0.00 1.59 1.74 0.00 3.27 0.00 0.00 3.29 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.67 0.00 8 D 8.64 4.24 0.00 2.47 2.46 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 9 G 7.64 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 10 M 8.47 6.02 0.00 1.61 1.56 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 11 F 8.93 4.89 0.00 2.83 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 12 S 8.84 4.70 0.00 3.75 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 13 G 8.22 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 0.00 0.00 0.00 14 V 8.17 4.49 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 0.82 0.00 0.00 1.09 0.00 0.00 15 V 8.28 4.42 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 0.90 0.00 0.00 0.97 0.00 0.00 16 I 8.60 4.43 2.14 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.77 1.23 0.00 0.00 17 T 9.19 4.73 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 1.29 0.00 0.00 18 Q 8.18 4.89 0.00 1.99 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.90 0.00 0.00 0.00 0.00 0.00 2.50 2.29 0.00 19 F 8.56 5.14 0.00 2.35 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 H 9.43 5.18 0.00 3.26 3.10 0.00 5.77 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 T 8.27 4.86 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 1.19 0.00 0.00 22 G 7.61 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 0.00 0.00 0.00 23 Q 8.52 5.06 0.00 1.90 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.03 6.65 0.00 0.00 0.00 0.00 0.00 2.23 2.30 0.00 24 I 8.54 4.54 1.95 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 0.97 1.41 0.60 0.00 0.00 25 D 9.62 4.20 0.00 2.60 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 26 N 8.34 4.29 0.00 2.84 2.86 0.00 0.00 7.04 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 27 K 7.91 4.50 0.00 1.79 1.66 0.00 1.63 0.00 0.00 1.75 0.00 0.00 2.93 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.31 1.43 7.81 28 P 0.00 4.98 0.00 1.92 2.06 0.00 3.42 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.78 0.00 29 Y 8.64 5.62 0.00 3.08 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 30 F 9.51 5.53 0.00 3.36 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 31 C 9.54 5.44 0.00 2.82 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 32 I 8.48 5.03 1.88 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.73 0.63 0.00 0.00 33 E 8.84 5.10 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 2.29 2.34 0.00 34 G 8.71 4.60 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 0.00 35 K 8.69 5.26 0.00 1.61 1.69 0.00 1.66 0.00 0.00 1.71 0.00 0.00 3.10 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.36 1.51 7.81 36 Q 8.69 4.91 0.00 2.12 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 5.95 0.00 0.00 0.00 0.00 0.00 2.43 2.46 0.00 37 S 8.13 4.09 0.00 4.19 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 0.00 38 A 7.82 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 39 G 7.71 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 0.00 0.00 0.00 40 S 7.78 4.27 0.00 4.14 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 41 S 8.52 5.26 0.00 3.87 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 42 I 8.56 4.20 0.56 0.00 0.00 -0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.65 0.72 0.00 0.00 43 S 8.56 5.48 0.00 3.63 3.63 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 44 A 8.16 4.87 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 45 C 9.59 5.30 0.00 2.91 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 46 S 8.15 5.40 0.00 3.88 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 47 M 8.79 5.17 0.00 1.82 1.18 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.34 0.00 48 K 8.19 3.91 0.00 0.79 1.20 0.00 1.62 0.00 0.00 1.47 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.35 1.38 7.81 49 N 8.90 4.52 0.00 2.88 2.91 0.00 0.00 7.08 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 50 S 7.45 4.54 0.00 4.47 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 0.00 51 S 8.92 4.20 0.00 3.97 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 52 V 7.74 3.72 1.29 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 0.62 0.00 0.00 -0.28 0.00 0.00 53 W 7.87 4.87 0.00 3.53 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 54 G 7.97 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 55 A 8.23 4.14 1.37 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 56 S 8.13 4.80 0.00 4.15 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 0.00 57 F 8.70 4.92 0.00 3.29 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 58 S 8.32 3.96 0.00 4.15 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 0.00 59 T 7.91 3.86 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 1.26 0.00 0.00 60 L 8.46 4.18 0.00 2.07 2.14 1.15 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 61 Y 8.16 2.67 0.00 2.19 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 62 N 7.94 4.02 0.00 2.96 2.76 0.00 0.00 6.74 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 63 Q 8.00 3.66 0.00 2.29 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.27 0.00 64 A 8.34 4.25 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 0.00 0.00 65 L 7.82 3.82 0.00 1.04 1.18 0.15 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 66 Y 7.84 3.89 0.00 3.04 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 67 F 8.44 4.69 0.00 3.26 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 68 Y 8.62 4.36 0.00 3.17 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 69 T 7.86 3.81 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 1.07 0.00 0.00 70 T 7.51 3.95 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 0.81 0.00 0.00 71 G 7.87 3.84 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 0.00 0.00 0.00 72 Q 7.65 4.27 0.00 2.07 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.61 6.77 0.00 0.00 0.00 0.00 0.00 2.39 2.17 0.00 73 P 0.00 4.62 0.00 1.92 2.00 0.00 3.58 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.09 0.00 74 V 8.89 4.45 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 -0.34 0.00 0.00 0.87 0.00 0.00 75 R 8.83 4.82 0.00 1.76 1.70 0.00 2.72 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 1.38 0.00 76 I 8.45 4.65 1.88 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.44 0.93 0.00 0.00 77 Y 8.88 4.97 0.00 2.98 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 78 Y 8.58 5.22 0.00 3.02 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 79 E 8.74 4.85 0.00 1.65 1.61 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 2.15 2.18 0.00 80 P 0.00 5.23 0.00 2.17 2.27 0.00 3.47 0.00 0.00 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.92 0.00 81 G 8.46 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 82 V 7.39 3.41 1.31 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 -0.34 0.00 0.00 0.88 0.00 0.00 83 W 7.43 4.86 0.00 3.43 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 84 T 8.49 4.48 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 1.24 0.00 0.00 85 Y 8.05 4.27 0.00 3.03 2.93 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 86 P 0.00 4.15 0.00 2.00 2.01 0.00 3.26 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.15 0.00 87 P 0.00 4.09 0.00 2.00 1.99 0.00 2.20 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.88 0.00 88 F 8.00 3.97 0.00 3.32 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 89 V 7.71 3.88 2.25 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 0.90 0.00 0.00 1.20 0.00 0.00 90 K 8.10 4.03 0.00 1.84 1.92 0.00 1.80 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.42 7.81 91 A 7.89 4.13 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 92 L 7.75 4.23 0.00 1.02 1.07 0.01 0.49 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 93 T 7.90 4.26 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 1.35 0.00 0.00 94 S 8.30 4.75 0.00 4.04 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 95 N 8.29 4.96 0.00 2.80 2.80 0.00 0.00 6.72 7.63 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 96 A 8.66 5.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 L 8.91 4.57 0.00 1.59 1.58 1.13 1.09 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 98 V 9.14 3.95 0.67 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 0.19 0.00 0.00 -0.94 0.00 0.00 99 G 7.53 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 L 8.47 5.78 0.00 1.79 1.98 1.20 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 101 S 9.01 5.12 0.00 3.92 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 0.00 102 T 8.90 4.24 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 1.57 0.00 0.00 103 C 8.56 5.51 0.00 2.92 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 0.00 104 T 8.97 4.08 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 1.22 0.00 0.00 105 T 7.35 4.73 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 1.21 0.00 0.00 106 S 8.69 3.93 0.00 3.97 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 0.00 107 T 7.38 4.39 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 1.17 0.00 0.00 108 E 8.19 4.61 0.00 2.11 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 0.00 2.27 2.33 0.00 109 C 8.37 5.35 0.00 2.92 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 0.00 110 F 8.84 4.58 0.00 2.92 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 0.00 111 G 8.54 3.49 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 0.00 0.00 0.00 112 P 0.00 4.50 0.00 1.74 2.02 0.00 3.63 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 1.50 1.66 0.00 113 D 8.34 4.61 0.00 2.57 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 0.00 114 R 8.57 4.48 0.00 2.07 1.78 0.00 3.16 0.00 0.00 3.34 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.66 0.00 115 K 8.06 4.40 0.00 1.81 1.54 0.00 1.66 0.00 0.00 1.55 0.00 0.00 2.76 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.30 1.33 7.81 116 K 8.68 4.27 0.00 1.91 1.65 0.00 1.86 0.00 0.00 1.73 0.00 0.00 2.82 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.41 1.42 7.81