NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4613 8.1927 115.4107 58.3466 64.4821 174.3030 3 V 3.2667 7.5622 123.7512 66.5880 32.1080 175.0771 4 Y 3.9542 8.7570 117.2745 61.2466 37.9203 177.8687 5 D 4.4012 8.1269 118.1545 57.2957 41.3043 178.2193 6 A 4.0882 8.0376 121.2028 54.9780 18.3663 179.5518 7 A 3.8881 8.3825 119.3808 54.9425 18.1646 179.4687 8 A 4.0409 7.5925 117.8684 54.6078 18.4989 178.9770 9 Q 4.3009 7.7837 115.0909 56.4017 29.9626 176.9137 10 L 4.2272 7.4586 121.4049 53.7978 40.2982 177.1033 11 T 4.2553 7.7048 114.6029 60.2096 71.6485 175.1436 12 A 3.9576 8.4737 122.4641 55.8249 18.2496 179.6732 13 D 4.3134 7.9941 116.5687 57.2677 40.9409 179.0925 14 V 3.4987 7.3491 117.7002 65.8891 31.5705 178.2635 15 K 3.8667 8.3614 118.7258 59.2011 31.8556 179.2343 16 K 3.9592 8.0699 119.9109 59.7406 32.1700 178.7054 17 D 4.6274 8.0801 119.0422 57.1358 40.5613 178.8186 18 L 3.7543 7.9124 119.6649 57.8390 41.6277 179.7595 19 R 4.0480 8.0857 117.9761 59.3659 29.5529 178.9389 20 D 4.4800 8.4203 119.0306 57.4180 40.7844 178.9972 21 S 3.0384 8.2704 114.8698 60.7007 63.0731 176.3380 22 W 4.2950 8.7905 132.3047 60.0011 30.2041 177.7174 23 K 3.9996 7.9681 119.1011 58.8482 31.7906 178.1803 24 V 3.9321 6.9293 114.6624 64.9530 32.0097 177.9292 25 I 3.4163 7.6579 119.7925 64.2956 36.9674 178.0232 26 G 2.3593 6.8900 106.3018 45.4676 0.0000 174.3630 27 S 4.1661 7.1688 114.3829 59.5895 63.8756 174.3938 28 D 4.6050 7.2346 119.3424 51.2800 41.2552 175.3761 29 K 3.9454 8.0118 123.3743 58.4723 32.4185 178.4432 30 K 4.0013 7.9449 119.6335 59.3862 32.3538 178.9821 31 G 3.6241 8.1440 107.2148 47.5473 0.0000 175.4403 32 N 4.4665 8.2992 119.6086 55.3475 38.5359 177.9690 33 G 3.4997 8.0514 107.4424 47.7781 0.0000 176.0350 34 V 3.5292 7.8543 120.6821 65.5059 31.5562 177.9653 35 A 3.9175 7.8983 120.6180 54.8140 18.1367 179.3915 36 L 3.7179 7.9226 118.8960 58.5614 42.2254 179.2225 37 M 3.4913 7.6961 118.7568 58.4190 31.8598 178.9753 38 T 3.8658 7.9990 110.1937 64.9614 68.7789 176.7456 39 T 3.8908 7.7181 118.7291 66.0965 68.4175 176.5628 40 L 3.8733 7.5247 122.3662 58.2651 41.9826 179.1590 41 F 4.5936 7.9420 117.4929 60.4313 38.5512 177.6734 42 A 4.0527 7.9300 119.9282 55.2523 18.3518 179.0276 43 D 4.6408 8.2093 115.9044 55.5927 42.6092 176.9006 44 N 5.0850 8.3103 116.6573 49.8362 39.4200 174.4470 45 Q 4.3905 8.6051 121.9674 58.6639 28.8409 179.0631 46 E 4.0781 8.3362 118.8144 59.2489 29.5187 178.8216 47 T 4.4400 8.4186 110.5362 64.2218 68.8265 176.4567 48 I 3.7912 8.0932 123.3604 64.0256 36.7501 178.1542 49 G 3.5026 7.7626 105.5632 47.6189 0.0000 174.5458 50 Y 4.2572 7.7855 116.7462 58.6208 38.4624 175.8995 51 F 4.9916 8.1081 119.9181 56.5902 40.0991 177.7114 52 K 3.9027 8.3489 124.3609 59.5388 32.1778 178.5189 53 R 4.0071 7.9883 117.6866 58.9993 30.1048 177.1741 54 L 4.2258 7.9322 116.6050 55.3246 42.7906 179.0532 55 G 3.8717 7.6764 106.9860 46.9388 0.0000 177.5835 56 D 4.5878 8.3632 117.5374 53.4479 39.4242 176.4621 57 V 3.8628 7.9111 118.1154 62.8686 31.7137 177.1305 58 S 4.3653 7.8909 112.8597 60.4230 63.0800 175.7350 59 Q 4.1433 8.2931 121.9973 56.5655 28.9084 177.0909 60 G 3.8814 8.5510 109.1817 46.1994 0.0000 176.1208 61 M 3.8776 9.0434 121.3220 58.5063 31.9683 177.3310 62 A 3.9912 7.5783 120.2827 54.1880 18.8342 177.3075 63 N 4.5688 8.1936 115.1135 52.8905 39.2168 174.8914 64 D 4.4127 8.7552 129.1987 57.6623 40.9824 179.1577 65 K 4.0328 8.0031 118.1994 59.3305 32.0813 179.0452 66 L 3.9995 7.8867 120.1886 58.1385 42.0974 178.8184 67 R 3.9957 8.5183 119.2901 59.3341 30.0822 178.7169 68 G 3.6389 8.5513 106.0518 48.0331 0.0000 175.2242 69 H 4.2506 8.5006 120.7415 59.0881 29.7908 177.5234 70 S 4.0329 8.4325 117.3597 61.7144 62.4489 176.8463 71 I 3.7917 7.7069 121.2067 64.7751 37.0457 178.3695 72 T 4.1701 7.8886 116.1491 66.4875 68.2724 176.4737 73 L 3.9596 8.1073 122.4916 58.4435 42.0970 179.0062 74 M 4.2459 7.8901 118.5352 58.2746 31.8410 177.9176 75 Y 4.0606 7.8557 115.9543 59.8009 38.1056 177.6639 76 A 3.7846 7.7546 122.4481 54.8345 18.4284 179.6367 77 L 3.5223 7.4577 117.0508 57.5601 41.7154 179.2116 78 Q 3.5532 7.8887 119.6040 58.9143 28.7548 177.7999 79 N 4.2635 7.6787 116.8951 56.8113 39.3965 176.3845 80 F 4.5719 7.8070 118.9407 60.8502 38.9573 177.7216 81 I 3.5336 7.7596 119.5470 64.5394 36.6310 178.3187 82 D 4.4659 8.0473 118.2864 56.6121 40.9219 177.7502 83 Q 4.4198 7.6721 116.4573 55.4967 28.8278 177.1390 84 L 3.8857 7.4357 121.1585 58.1556 41.7446 178.1682 85 D 4.5098 7.9394 114.7327 55.2039 41.0972 176.5561 86 N 4.8239 8.2143 118.1665 49.9287 40.1280 172.0016 87 P 4.1486 0.0000 0.0000 65.8629 31.1090 177.9861 88 D 4.4661 8.2338 118.0487 57.3994 40.8078 178.2393 89 D 4.3617 8.1945 119.0413 56.9246 40.8994 178.4956 90 L 3.8214 8.0951 121.2186 58.1400 42.0265 179.2334 91 V 3.2824 7.8352 118.6952 66.0179 31.3098 177.8017 92 C 4.1052 7.7914 113.9702 61.2590 29.4595 176.1313 93 V 3.8155 7.8096 114.7266 63.6449 31.2073 178.7457 94 V 3.4761 7.6638 118.4719 65.9383 31.2177 177.9924 95 E 3.9335 8.2825 118.4359 58.8861 28.9603 179.3163 96 K 3.9468 7.6338 118.9122 59.4547 31.9719 178.2091 97 L 4.1604 8.0251 120.4218 58.2778 41.9237 178.7901 98 A 4.1733 8.1825 120.6422 54.8237 18.2670 179.3487 99 V 3.5218 7.5067 117.1282 66.8553 31.6578 178.2301 100 N 4.4336 8.1338 115.0413 56.3949 38.4586 177.0736 101 H 4.2467 7.8407 118.3364 58.4677 28.7447 177.8967 102 I 3.7271 8.1409 122.2532 64.7582 36.7590 178.5173 103 T 4.0161 7.6199 115.1170 66.5179 68.3358 175.9984 104 R 4.1979 7.6293 116.6530 55.4490 30.6524 176.2619 105 K 3.8377 8.1926 117.7314 57.5108 29.9529 176.0939 106 I 4.1616 7.7267 120.1997 59.8068 37.6973 177.2462 107 S 4.4722 8.4153 120.8991 57.5558 65.3531 174.7980 108 A 3.9883 8.4803 123.1800 55.1357 17.8228 179.7553 109 A 3.9908 7.9081 118.1494 55.2652 18.8908 179.0067 110 E 4.0741 8.2000 117.7337 59.4799 29.9010 178.7565 111 F 4.1237 8.6385 121.0490 61.1639 39.4610 176.9807 112 G 3.8794 8.4472 104.5049 46.6203 0.0000 175.2686 113 K 4.1827 8.0178 120.7611 58.5732 32.0195 178.4145 114 I 3.4437 7.5389 118.5956 62.9887 37.8203 177.2604 115 N 4.4628 8.2216 117.9865 56.3909 38.3301 177.3200 116 G 3.5905 7.6283 106.7234 47.4547 0.0000 173.9251 117 P 4.2214 0.0000 0.0000 65.1145 31.2648 178.7800 118 I 3.4841 7.6593 118.5719 64.1796 37.0298 178.2494 119 K 3.8998 8.1212 120.4542 59.5907 31.9451 178.9786 120 K 3.9875 8.0728 118.6698 59.3563 31.9299 179.5726 121 V 3.5307 8.0093 118.8908 65.8267 31.3347 178.0340 122 L 3.9630 8.1908 118.8803 57.9212 41.4484 179.4533 123 A 4.1365 8.1359 120.8175 55.0542 18.0554 179.7172 124 S 4.1169 8.0550 111.8776 60.4752 63.0354 175.8298 125 K 4.3833 7.1290 119.7462 55.3991 32.2801 175.6250 126 N 4.1166 8.0682 115.3322 54.3778 36.1147 174.2132 127 F 4.4509 8.2317 118.1278 55.6341 39.9733 176.8069 128 G 4.0741 8.6127 116.7363 44.8943 0.0000 172.2532 129 D 4.4707 9.0227 117.7640 57.5213 40.4581 178.6514 130 K 3.7753 8.2250 119.4201 60.1132 32.0708 178.2196 131 Y 4.1560 8.1304 116.1015 60.8627 37.8299 177.9919 132 A 4.2328 8.1853 121.4209 55.3689 18.6249 179.2831 133 N 4.3598 8.7438 115.2105 56.2728 38.4391 177.5573 134 A 3.9547 7.7860 122.3689 55.0519 18.4542 179.8036 135 W 3.8927 8.5489 117.2591 59.6866 29.1017 178.6611 136 A 4.1192 8.4253 120.9657 55.1007 17.5531 179.8582 137 K 3.9897 7.6813 115.9633 59.2621 32.3482 179.0992 138 L 3.9690 7.5846 121.0502 58.0536 41.9951 179.1222 139 V 3.8105 8.2007 118.1143 65.9723 31.4196 177.8471 140 A 4.5520 8.0472 121.8906 54.3823 17.8907 179.7906 141 V 3.4307 7.3408 116.5478 66.0007 31.7482 178.1703 142 V 3.4824 7.5181 117.5636 65.9859 31.5357 177.7438 143 Q 3.8226 8.1997 117.6568 58.9797 28.3212 178.8048 144 A 4.0571 7.8815 120.2149 53.9913 18.4719 178.3899 145 A 4.3305 7.7627 117.6217 52.2004 19.5851 177.0719 146 L 4.1372 7.3452 121.9881 54.6356 41.8754 176.4113 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 S 8.19 4.46 0.00 4.25 4.12 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 3 V 7.56 3.27 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 0.93 0.00 0.00 0.83 0.00 0.00 4 Y 8.76 3.95 0.00 3.02 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 5 D 8.13 4.40 0.00 2.81 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 6 A 8.04 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 7 A 8.38 3.89 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 8 A 7.59 4.04 1.39 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 0.00 0.00 0.00 9 Q 7.78 4.30 0.00 2.13 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 7.19 0.00 0.00 0.00 0.00 0.00 2.36 2.51 0.00 10 L 7.46 4.23 0.00 1.69 1.53 0.77 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 11 T 7.70 4.26 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 1.18 0.00 0.00 12 A 8.47 3.96 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 13 D 7.99 4.31 0.00 2.66 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 14 V 7.35 3.50 2.23 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 0.91 0.00 0.00 0.87 0.00 0.00 15 K 8.36 3.87 0.00 1.90 1.79 0.00 1.78 0.00 0.00 1.53 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.47 7.81 16 K 8.07 3.96 0.00 1.95 1.98 0.00 1.57 0.00 0.00 1.68 0.00 0.00 3.08 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.46 1.58 7.81 17 D 8.08 4.63 0.00 2.80 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 7.91 3.75 0.00 1.65 1.25 0.55 -0.60 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 19 R 8.09 4.05 0.00 1.91 2.05 0.00 3.14 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.80 0.00 20 D 8.42 4.48 0.00 3.11 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 21 S 8.27 3.04 0.00 3.33 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 22 W 8.79 4.29 0.00 3.73 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 23 K 7.97 4.00 0.00 2.04 2.03 0.00 1.87 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.47 7.81 24 V 6.93 3.93 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 1.06 0.00 0.00 1.10 0.00 0.00 25 I 7.66 3.42 1.65 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 1.17 0.97 0.66 0.00 0.00 26 G 6.89 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 S 7.17 4.17 0.00 3.91 4.01 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 28 D 7.23 4.61 0.00 2.66 2.39 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 0.00 29 K 8.01 3.95 0.00 1.74 1.70 0.00 1.22 0.00 0.00 0.77 0.00 0.00 2.24 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.22 1.35 7.81 30 K 7.94 4.00 0.00 1.82 1.77 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.50 7.81 31 G 8.14 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.30 4.47 0.00 2.70 2.72 0.00 0.00 6.98 7.15 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 33 G 8.05 3.50 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 0.00 34 V 7.85 3.53 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 1.07 0.00 0.00 0.93 0.00 0.00 35 A 7.90 3.92 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 36 L 7.92 3.72 0.00 1.87 1.67 0.75 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 37 M 7.70 3.49 0.00 1.47 1.82 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.63 0.00 38 T 8.00 3.87 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 39 T 7.72 3.89 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 1.20 0.00 0.00 40 L 7.52 3.87 0.00 1.65 1.42 0.90 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.94 4.59 0.00 3.21 2.92 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 42 A 7.93 4.05 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.21 4.64 0.00 2.74 2.75 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 44 N 8.31 5.09 0.00 2.99 2.90 0.00 0.00 6.57 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 45 Q 8.61 4.39 0.00 2.29 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.89 0.00 0.00 0.00 0.00 0.00 2.45 2.33 0.00 46 E 8.34 4.08 0.00 2.22 2.30 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 2.48 2.39 0.00 47 T 8.42 4.44 4.68 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 1.43 0.00 0.00 48 I 8.09 3.79 1.86 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.41 0.57 0.69 0.00 0.00 49 G 7.76 3.50 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 0.00 50 Y 7.79 4.26 0.00 2.65 2.50 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 51 F 8.11 4.99 0.00 3.00 3.03 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 52 K 8.35 3.90 0.00 1.76 1.81 0.00 1.71 0.00 0.00 1.72 0.00 0.00 2.85 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.43 7.81 53 R 7.99 4.01 0.00 1.84 2.01 0.00 3.32 0.00 0.00 3.26 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 54 L 7.93 4.23 0.00 1.87 1.77 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 55 G 7.68 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 0.00 0.00 0.00 56 D 8.36 4.59 0.00 2.72 2.58 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 0.00 57 V 7.91 3.86 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 0.84 0.00 0.00 0.69 0.00 0.00 58 S 7.89 4.37 0.00 4.05 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 59 Q 8.29 4.14 0.00 2.29 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 5.88 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 60 G 8.55 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 61 M 9.04 3.88 0.00 1.96 2.12 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.62 0.00 62 A 7.58 3.99 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 63 N 8.19 4.57 0.00 2.83 2.92 0.00 0.00 7.01 8.03 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 64 D 8.76 4.41 0.00 2.74 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 65 K 8.00 4.03 0.00 1.84 1.91 0.00 1.70 0.00 0.00 1.87 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.56 1.52 7.81 66 L 7.89 4.00 0.00 1.81 1.86 0.96 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 67 R 8.52 4.00 0.00 2.13 2.07 0.00 3.15 0.00 0.00 3.38 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 68 G 8.55 3.64 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 0.00 0.00 0.00 69 H 8.50 4.25 0.00 3.36 3.53 0.00 5.79 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 70 S 8.43 4.03 0.00 3.99 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 71 I 7.71 3.79 1.95 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 1.56 0.65 1.15 0.00 0.00 72 T 7.89 4.17 4.41 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 1.25 0.00 0.00 73 L 8.11 3.96 0.00 1.65 1.78 0.88 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 74 M 7.89 4.25 0.00 2.06 2.16 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.89 0.00 75 Y 7.86 4.06 0.00 3.15 3.03 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 76 A 7.75 3.78 1.12 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 0.00 0.00 77 L 7.46 3.52 0.00 1.47 1.15 0.95 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 78 Q 7.89 3.55 0.00 2.42 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.79 0.00 0.00 0.00 0.00 0.00 2.53 2.52 0.00 79 N 7.68 4.26 0.00 2.86 2.84 0.00 0.00 7.29 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 80 F 7.81 4.57 0.00 3.01 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 81 I 7.76 3.53 1.58 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.47 0.84 0.00 0.00 82 D 8.05 4.47 0.00 2.82 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 83 Q 7.67 4.42 0.00 2.06 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.73 0.00 0.00 0.00 0.00 0.00 2.72 2.56 0.00 84 L 7.44 3.89 0.00 1.55 1.68 0.77 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 85 D 7.94 4.51 0.00 2.66 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 86 N 8.21 4.82 0.00 2.70 2.64 0.00 0.00 6.85 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 87 P 0.00 4.15 0.00 2.41 2.32 0.00 3.76 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.11 0.00 88 D 8.23 4.47 0.00 2.95 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 89 D 8.19 4.36 0.00 2.79 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 90 L 8.10 3.82 0.00 1.82 1.66 0.65 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 91 V 7.84 3.28 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.10 0.00 0.00 92 C 7.79 4.11 0.00 3.14 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 93 V 7.81 3.82 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 0.79 0.00 0.00 1.15 0.00 0.00 94 V 7.66 3.48 1.91 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 0.76 0.00 0.00 0.16 0.00 0.00 95 E 8.28 3.93 0.00 1.99 1.94 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 2.23 2.39 0.00 96 K 7.63 3.95 0.00 1.80 2.09 0.00 1.72 0.00 0.00 1.65 0.00 0.00 3.08 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.53 7.81 97 L 8.03 4.16 0.00 2.07 2.02 0.93 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 98 A 8.18 4.17 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 99 V 7.51 3.52 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 1.03 0.00 0.00 1.04 0.00 0.00 100 N 8.13 4.43 0.00 2.77 2.82 0.00 0.00 7.02 8.16 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 0.00 101 H 7.84 4.25 0.00 3.52 3.37 0.00 5.81 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 I 8.14 3.73 2.03 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 1.50 0.70 0.91 0.00 0.00 103 T 7.62 4.02 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 1.21 0.00 0.00 104 R 7.63 4.20 0.00 1.94 1.98 0.00 3.17 0.00 0.00 3.12 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.83 0.00 105 K 8.19 3.84 0.00 1.95 1.96 0.00 1.72 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.42 7.81 106 I 7.73 4.16 1.99 0.00 0.00 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 0.69 0.52 0.90 0.00 0.00 107 S 8.42 4.47 0.00 4.08 4.05 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 0.00 108 A 8.48 3.99 1.39 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 0.00 0.00 0.00 109 A 7.91 3.99 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 0.00 110 E 8.20 4.07 0.00 2.20 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 0.00 2.23 2.33 0.00 111 F 8.64 4.12 0.00 3.28 3.19 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 0.00 112 G 8.45 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 0.00 113 K 8.02 4.18 0.00 1.96 1.89 0.00 1.91 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.50 1.72 7.81 114 I 7.54 3.44 1.54 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.09 0.75 0.00 0.00 115 N 8.22 4.46 0.00 2.96 2.89 0.00 0.00 6.71 7.62 0.00 0.00 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 G 7.63 3.59 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 0.00 0.00 0.00 117 P 0.00 4.22 0.00 2.17 2.15 0.00 3.66 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 2.03 2.12 0.00 118 I 7.66 3.48 1.95 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 1.14 0.70 0.58 0.00 0.00 119 K 8.12 3.90 0.00 1.92 2.03 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.54 7.81 120 K 8.07 3.99 0.00 1.96 1.80 0.00 1.70 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.61 7.81 121 V 8.01 3.53 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 0.90 0.00 0.00 0.89 0.00 0.00 122 L 8.19 3.96 0.00 1.94 1.96 0.91 0.38 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 0.00 123 A 8.14 4.14 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 0.00 124 S 8.06 4.12 0.00 4.03 4.09 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 0.00 125 K 7.13 4.38 0.00 2.20 1.95 0.00 1.81 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.51 1.60 7.81 126 N 8.07 4.12 0.00 2.60 2.76 0.00 0.00 6.80 8.23 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 0.00 127 F 8.23 4.45 0.00 3.01 2.81 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 0.00 128 G 8.61 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 0.00 0.00 0.00 129 D 9.02 4.47 0.00 2.74 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 0.00 130 K 8.23 3.78 0.00 1.76 1.64 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.85 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.17 1.38 7.81 131 Y 8.13 4.16 0.00 3.46 3.19 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 0.00 132 A 8.19 4.23 1.45 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 0.00 0.00 133 N 8.74 4.36 0.00 2.90 2.90 0.00 0.00 6.91 7.74 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 0.00 134 A 7.79 3.95 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 0.00 135 W 8.55 3.89 0.00 3.63 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 0.00 136 A 8.43 4.12 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 0.00 0.00 137 K 7.68 3.99 0.00 1.88 1.83 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.68 7.81 138 L 7.58 3.97 0.00 1.43 1.73 0.69 0.49 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 0.00 139 V 8.20 3.81 2.35 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 1.19 0.00 0.00 1.21 0.00 0.00 140 A 8.05 4.55 1.39 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 0.00 0.00 0.00 141 V 7.34 3.43 2.00 0.00 0.00 0.00 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 0.81 0.00 0.00 142 V 7.52 3.48 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 0.40 0.00 0.00 0.89 0.00 0.00 143 Q 8.20 3.82 0.00 2.30 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.51 2.74 0.00 144 A 7.88 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 145 A 7.76 4.33 1.18 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 0.00 146 L 7.35 4.14 0.00 1.70 1.51 0.50 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00