NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 V 3.9570 8.0549 120.3042 61.9145 32.5944 175.6118 3 H 4.5487 8.4011 120.1190 53.7969 27.6572 171.0587 4 L 4.7498 7.7526 122.5396 52.6125 44.1682 177.2711 5 T 4.0344 8.2997 114.7216 61.5436 70.5165 173.3927 6 P 4.2733 0.0000 0.0000 65.1577 31.3277 178.4211 7 E 3.8886 8.1916 118.1047 59.5819 29.4705 178.5714 8 E 3.9281 7.9712 117.8648 59.1537 29.5149 179.2343 9 K 3.8140 8.0957 119.8228 59.6597 32.2997 178.9915 10 S 4.1261 8.1434 114.1933 61.3377 62.9044 176.2302 11 A 4.0064 8.1715 124.4702 54.7677 18.0984 179.7675 12 V 3.6406 7.9753 116.7761 66.5145 31.6365 178.0388 13 T 3.9744 7.8709 115.2691 66.8652 68.1492 176.2886 14 A 3.9998 7.9023 120.7411 55.0618 18.7768 178.9983 15 L 3.8613 8.0064 118.9006 58.2192 42.1621 179.1299 16 W 4.3340 8.7947 128.3295 60.2887 30.4506 178.1162 17 G 3.7101 8.1705 105.1104 47.2125 0.0000 174.9308 18 K 4.3118 7.8177 118.2637 56.0798 32.7117 176.9541 19 V 3.7580 7.0230 120.4477 61.8815 32.2050 175.4297 20 N 4.5315 8.2169 125.3330 52.3367 39.3919 175.6738 21 V 3.3627 8.0680 128.6325 66.1772 31.8222 176.7080 22 D 4.3184 8.2156 117.7380 58.1608 40.6255 178.3175 23 E 3.7955 8.2055 118.1624 59.5982 29.7557 179.2624 24 V 3.5748 8.6767 119.0783 65.9183 31.5820 178.4066 25 G 3.7088 8.4883 105.9067 47.8238 0.0000 175.9537 26 G 3.5687 8.0798 108.4787 47.4221 0.0000 175.7268 27 E 3.9272 8.2413 120.8517 58.9315 29.4032 179.3224 28 A 3.9064 8.4971 121.0622 55.1521 18.5270 179.3637 29 L 3.9732 8.1149 119.1116 58.3025 41.9688 179.5100 30 G 3.5472 8.1777 105.6213 47.6756 0.0000 175.9139 31 R 3.8356 8.3300 121.0014 58.8849 30.1088 178.5257 32 L 3.9939 8.0115 120.2816 58.6973 42.1208 179.2006 33 L 4.0960 7.7232 117.6577 56.9144 41.3300 179.2094 34 V 3.7403 7.1444 117.4707 65.1541 31.9456 177.8544 35 V 3.5333 7.8427 117.3016 64.4368 32.8081 175.7173 36 Y 3.8494 7.2913 115.6586 54.1980 38.3202 173.9486 37 P 4.9043 0.0000 0.0000 64.0785 31.9768 177.7293 38 W 4.3569 7.9464 115.4413 59.0992 27.6227 178.0413 39 T 4.1136 7.6515 110.8471 64.2334 68.2897 176.1719 40 Q 4.3256 8.1781 121.5435 58.4499 28.5526 178.7666 41 R 3.8478 7.4728 115.8765 58.3499 29.3023 177.8166 42 F 4.3239 6.9410 115.8295 57.4964 39.6980 175.7978 43 F 4.5948 7.5401 118.1976 56.4492 39.9695 177.0859 44 E 4.0088 8.5114 122.7856 59.6751 29.4753 179.9840 45 S 4.3476 8.0170 111.7821 60.9324 63.3656 175.0983 46 F 4.5857 8.1178 118.6494 58.5716 39.6554 176.4290 47 G 4.0064 7.8522 107.2266 45.1217 0.0000 174.5475 48 D 4.7024 8.5809 125.7719 53.2985 41.4170 175.9956 49 L 4.8546 8.3954 127.9425 54.6041 42.6141 177.6238 50 S 4.4902 8.2154 114.1808 59.6043 64.0818 174.3836 51 T 4.7088 7.3567 111.1243 58.3364 72.8890 172.2140 52 P 4.1609 0.0000 0.0000 66.2313 31.3523 178.1664 53 D 4.4324 8.2011 116.4578 57.6777 40.5499 178.9010 54 A 3.9818 7.5023 118.8247 55.3295 18.6446 179.5755 55 V 3.6681 7.8072 116.3559 66.6591 31.4853 178.2617 56 M 4.1800 8.6882 117.8866 58.0004 31.8644 178.4727 57 G 3.7915 8.2788 104.7468 45.0343 0.0000 173.7102 58 N 4.4487 7.5960 121.5588 53.0553 39.5570 173.7311 59 P 4.4083 0.0000 0.0000 64.8175 31.8750 178.6189 60 K 3.5629 7.9008 118.8182 59.0389 31.7082 178.9851 61 V 3.6419 7.9404 118.0448 66.2090 31.3289 178.0065 62 K 3.8865 7.7513 117.5804 59.4694 31.9206 179.2339 63 A 3.9477 8.0836 121.0823 55.4347 18.2139 179.2231 64 H 4.3675 8.8252 117.2873 59.1868 29.8453 177.8118 65 G 3.5544 8.4579 108.1638 47.4206 0.0000 175.2876 66 K 3.8477 8.1664 122.2721 59.2967 32.2634 178.3099 67 K 3.8556 8.0702 119.4993 59.7907 32.1132 178.8034 68 V 3.6440 8.0751 118.5304 66.0151 31.4344 177.6598 69 L 4.4164 8.4480 120.0881 57.4275 41.9338 178.9355 70 G 3.7677 8.6772 106.4481 47.9859 0.0000 175.6017 71 A 4.2091 7.9023 121.6767 54.4433 18.6831 179.2279 72 F 4.2297 8.5001 119.5539 61.5197 39.6096 177.3385 73 S 4.1095 8.7589 115.1279 62.0803 62.9129 176.4278 74 D 4.5138 8.2408 121.3512 57.2235 40.5236 178.7727 75 G 3.6671 7.8064 104.7433 45.9726 0.0000 175.7781 76 L 3.7492 7.2261 120.1342 57.4345 41.5573 178.8736 77 A 4.0328 7.3043 119.0391 53.8421 19.2586 177.1108 78 H 4.8888 7.6829 114.7016 55.1318 29.4176 175.3869 79 L 3.9114 7.8103 121.5301 57.6497 42.5324 176.6778 80 D 4.7220 7.8682 115.9320 54.3147 41.7239 176.7812 81 N 5.0033 7.8719 117.7942 51.7847 40.3810 174.7682 82 L 4.0745 7.8496 122.7546 57.3801 42.0915 179.1687 83 K 4.1186 7.9793 117.4170 59.3970 32.3904 179.1936 84 G 3.6829 8.1864 105.7590 48.2211 0.0000 175.6850 85 T 3.6801 7.4018 117.1188 65.5614 68.6180 175.5978 86 F 4.7811 7.9286 116.5212 56.9930 39.4629 177.4217 87 A 4.0524 7.6522 122.5174 55.7124 18.2725 180.2964 88 T 3.8469 7.8918 113.6928 66.9166 68.5991 176.7798 89 L 4.1675 7.9971 120.3091 57.5237 41.6292 179.3539 90 S 4.4033 8.4100 115.2070 61.0070 62.3326 176.1054 91 E 3.8710 8.2008 121.2858 59.0523 29.0885 178.8565 92 L 3.9137 8.0081 120.4287 58.8235 42.1029 178.9974 93 H 4.1512 8.8590 116.2175 58.7454 28.7372 177.3870 94 C 3.5398 7.9898 120.8412 62.4325 31.1598 175.3961 95 D 4.3961 8.3981 119.9124 56.1921 40.5124 177.6246 96 K 4.2555 7.8818 117.6560 58.2387 33.0191 177.9487 97 L 4.1144 7.7017 115.7228 55.3720 42.3775 176.3783 98 H 4.0964 6.9703 114.0843 56.5279 26.7259 175.3631 99 V 3.7158 7.8788 117.9882 60.9986 32.3288 174.5943 100 D 4.2981 8.9378 126.9943 54.0822 41.3200 175.1134 101 P 2.9700 0.0000 0.0000 64.9223 31.8573 177.9253 102 E 3.7632 8.1282 118.7094 59.7475 29.1895 178.6385 103 N 4.2428 8.0439 116.2967 56.5028 38.4249 177.3385 104 F 4.4429 7.6803 119.2812 60.4888 38.9576 178.0364 105 R 3.9574 7.8689 117.4052 59.1615 29.9604 178.8152 106 L 3.8138 7.8635 118.8445 57.6603 41.4923 179.3849 107 L 4.0898 8.2833 120.5589 58.0112 42.0583 179.0233 108 G 3.7297 8.3699 105.9467 48.1554 0.0000 175.3717 109 N 4.4785 8.2280 118.8044 55.7890 38.5760 177.6167 110 V 3.6115 7.9923 119.7841 66.1369 31.5813 177.9079 111 L 3.8993 8.1701 120.0693 57.9665 41.8616 179.0209 112 V 3.6369 7.9176 118.3363 66.2845 31.4408 177.8439 113 C 4.1152 8.0743 116.4211 62.6876 27.9037 176.2527 114 V 3.5185 7.8286 119.9743 66.0038 31.0253 178.1618 115 L 3.9541 7.8483 118.5149 57.4613 41.3164 179.4270 116 A 3.5655 7.1207 120.7317 55.2055 18.1028 178.6509 117 H 3.9155 8.1352 115.8793 59.9377 29.9011 175.7615 118 H 3.8817 8.2791 119.5405 58.8153 29.9471 176.2097 119 F 4.5446 8.3701 116.6311 56.7538 40.6499 177.1314 120 G 3.7670 8.0429 110.8499 46.2386 0.0000 176.8778 121 K 4.2422 8.7954 122.3883 58.8352 32.6417 178.3354 122 Q 4.1220 7.9000 118.4229 58.7650 29.1292 177.0707 123 F 4.4151 8.0882 121.7843 57.3686 37.6222 175.3560 124 T 4.1658 7.3901 115.0479 60.2810 71.3079 173.5189 125 P 4.1682 0.0000 0.0000 65.7753 31.4008 177.1283 126 P 4.1963 0.0000 0.0000 65.3779 31.1532 178.9480 127 V 3.5270 7.5229 116.8051 66.0289 31.4149 177.2357 128 Q 3.6238 7.7110 119.0614 59.3209 28.7370 178.2999 129 A 3.9729 8.3609 121.0333 55.5895 18.3639 179.5835 130 A 3.9481 7.9967 118.8308 55.5459 18.3323 179.5169 131 Y 3.8421 8.4519 115.5760 60.9781 37.9008 178.5761 132 Q 4.1010 8.9088 119.6673 58.8435 28.8230 178.6712 133 K 3.9065 8.1154 119.5208 59.5208 32.1228 179.5644 134 V 3.5036 7.4422 118.5927 65.9925 31.5292 178.4856 135 V 3.9063 8.2778 119.0855 64.7957 31.1596 178.1686 136 A 4.1157 8.2372 121.6243 54.8768 18.2279 179.9191 137 G 3.4924 8.1639 104.3459 47.7220 0.0000 175.9936 138 V 3.2786 8.3303 120.8582 65.6050 31.6738 177.5241 139 A 3.8897 7.8952 120.2924 55.6837 17.9779 179.4293 140 N 4.2976 8.3926 113.2074 56.2829 39.0187 177.1667 141 A 4.1659 8.4067 122.5956 55.3367 18.4223 179.7656 142 L 3.8154 8.2955 117.1600 57.2556 41.4490 179.1664 143 A 4.2564 7.8219 120.0837 54.3087 18.4493 178.8219 144 H 4.2825 7.9351 116.2426 58.9629 29.8832 175.9129 145 K 4.4650 7.7317 117.1964 56.3249 32.0252 176.2135 146 Y 4.1120 8.1006 117.8327 58.2159 38.4698 175.5486 147 H 4.4554 8.2390 117.7683 56.1389 28.3266 173.2490 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 V 8.05 3.96 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 0.86 0.00 0.00 0.87 0.00 0.00 3 H 8.40 4.55 0.00 3.20 3.26 0.00 5.69 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 L 7.75 4.75 0.00 1.57 1.55 0.80 0.88 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 5 T 8.30 4.03 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 1.20 0.00 0.00 6 P 0.00 4.27 0.00 2.17 2.12 0.00 3.60 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 2.09 2.11 0.00 7 E 8.19 3.89 0.00 1.98 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 2.37 2.35 0.00 8 E 7.97 3.93 0.00 2.15 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 2.31 2.30 0.00 9 K 8.10 3.81 0.00 2.10 1.85 0.00 1.47 0.00 0.00 1.80 0.00 0.00 3.06 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.44 7.81 10 S 8.14 4.13 0.00 4.11 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 0.00 11 A 8.17 4.01 1.40 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 0.00 0.00 12 V 7.98 3.64 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 0.69 0.00 0.00 0.44 0.00 0.00 13 T 7.87 3.97 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 1.26 0.00 0.00 14 A 7.90 4.00 1.36 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 15 L 8.01 3.86 0.00 2.08 1.89 0.22 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 16 W 8.79 4.33 0.00 3.93 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 17 G 8.17 3.71 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 0.00 0.00 0.00 0.00 18 K 7.82 4.31 0.00 1.97 2.10 0.00 1.68 0.00 0.00 1.47 0.00 0.00 3.25 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.59 7.81 19 V 7.02 3.76 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 -0.06 0.00 0.00 0.83 0.00 0.00 20 N 8.22 4.53 0.00 2.68 2.55 0.00 0.00 6.86 7.71 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 21 V 8.07 3.36 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 1.11 0.00 0.00 0.94 0.00 0.00 22 D 8.22 4.32 0.00 3.01 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 23 E 8.21 3.80 0.00 1.96 1.97 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 2.13 2.22 0.00 24 V 8.68 3.57 1.99 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 0.91 0.00 0.00 0.71 0.00 0.00 25 G 8.49 3.71 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 0.00 0.00 0.00 0.00 26 G 8.08 3.57 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 0.00 27 E 8.24 3.93 0.00 2.05 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 2.27 2.40 0.00 28 A 8.50 3.91 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 29 L 8.11 3.97 0.00 1.84 1.64 0.94 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 30 G 8.18 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.33 3.84 0.00 1.85 1.92 0.00 3.08 0.00 0.00 3.00 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.73 0.00 32 L 8.01 3.99 0.00 1.91 1.97 1.02 0.86 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 33 L 7.72 4.10 0.00 1.92 1.68 1.10 0.93 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 34 V 7.14 3.74 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 0.73 0.00 0.00 0.94 0.00 0.00 35 V 7.84 3.53 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 0.03 0.00 0.00 0.73 0.00 0.00 36 Y 7.29 3.85 0.00 2.62 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 37 P 0.00 4.90 0.00 2.25 2.11 0.00 3.90 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 2.20 2.10 0.00 38 W 7.95 4.36 0.00 3.50 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 39 T 7.65 4.11 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 1.05 0.00 0.00 40 Q 8.18 4.33 0.00 2.25 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.84 0.00 0.00 0.00 0.00 0.00 2.45 2.50 0.00 41 R 7.47 3.85 0.00 1.59 1.90 0.00 2.89 0.00 0.00 2.32 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.50 0.00 42 F 6.94 4.32 0.00 1.53 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 0.00 0.00 0.00 0.00 43 F 7.54 4.59 0.00 2.76 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 0.00 0.00 0.00 44 E 8.51 4.01 0.00 1.99 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 2.33 2.20 0.00 45 S 8.02 4.35 0.00 4.11 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 46 F 8.12 4.59 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 47 G 7.85 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 0.00 0.00 0.00 48 D 8.58 4.70 0.00 2.65 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 49 L 8.40 4.85 0.00 1.77 1.63 1.05 1.02 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 50 S 8.22 4.49 0.00 3.98 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 51 T 7.36 4.71 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 52 P 0.00 4.16 0.00 2.14 2.12 0.00 3.61 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 2.09 2.17 0.00 53 D 8.20 4.43 0.00 2.67 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 54 A 7.50 3.98 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 55 V 7.81 3.67 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 1.04 0.00 0.00 0.99 0.00 0.00 56 M 8.69 4.18 0.00 1.95 2.09 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.87 0.00 57 G 8.28 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 0.00 0.00 0.00 0.00 58 N 7.60 4.45 0.00 3.01 2.88 0.00 0.00 6.76 7.76 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 59 P 0.00 4.41 0.00 2.24 2.24 0.00 3.71 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 1.98 2.01 0.00 60 K 7.90 3.56 0.00 1.51 0.74 0.00 1.58 0.00 0.00 1.27 0.00 0.00 2.83 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.17 1.26 7.81 61 V 7.94 3.64 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 1.13 0.00 0.00 1.06 0.00 0.00 62 K 7.75 3.89 0.00 1.88 1.80 0.00 1.68 0.00 0.00 1.62 0.00 0.00 3.16 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.42 7.81 63 A 8.08 3.95 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 64 H 8.83 4.37 0.00 3.34 3.42 0.00 5.79 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 65 G 8.46 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.17 3.85 0.00 1.96 2.04 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.48 7.81 67 K 8.07 3.86 0.00 2.07 1.92 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.53 7.81 68 V 8.08 3.64 2.16 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 0.99 0.00 0.00 0.89 0.00 0.00 69 L 8.45 4.42 0.00 2.03 1.79 1.45 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 70 G 8.68 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 0.00 0.00 0.00 71 A 7.90 4.21 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.50 4.23 0.00 3.27 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 73 S 8.76 4.11 0.00 4.48 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 0.00 74 D 8.24 4.51 0.00 2.84 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 75 G 7.81 3.67 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 0.00 0.00 0.00 76 L 7.23 3.75 0.00 1.50 1.49 0.09 -0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 77 A 7.30 4.03 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 78 H 7.68 4.89 0.00 3.09 3.12 0.00 5.82 0.00 0.00 0.00 0.00 8.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 7.81 3.91 0.00 1.47 1.61 0.80 1.16 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 80 D 7.87 4.72 0.00 2.67 2.65 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 0.00 0.00 0.00 0.00 81 N 7.87 5.00 0.00 2.73 2.59 0.00 0.00 7.20 6.05 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 82 L 7.85 4.07 0.00 1.75 1.83 0.89 1.06 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 83 K 7.98 4.12 0.00 1.68 1.83 0.00 1.42 0.00 0.00 1.19 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.44 7.81 84 G 8.19 3.68 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 0.00 0.00 0.00 85 T 7.40 3.68 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 0.51 0.00 0.00 86 F 7.93 4.78 0.00 3.19 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 87 A 7.65 4.05 1.42 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 0.00 0.00 88 T 7.89 3.85 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 1.23 0.00 0.00 89 L 8.00 4.17 0.00 2.03 1.86 1.15 0.93 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 90 S 8.41 4.40 0.00 4.14 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 91 E 8.20 3.87 0.00 2.23 1.96 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 2.32 2.50 0.00 92 L 8.01 3.91 0.00 1.87 1.87 0.92 0.86 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 93 H 8.86 4.15 0.00 3.70 3.81 0.00 5.86 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 C 7.99 3.54 0.00 1.23 2.52 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 95 D 8.40 4.40 0.00 2.69 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 96 K 7.88 4.26 0.00 1.77 1.82 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.36 1.52 7.81 97 L 7.70 4.11 0.00 1.66 1.61 0.70 1.10 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 98 H 6.97 4.10 0.00 3.45 3.41 0.00 5.64 0.00 0.00 0.00 0.00 8.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 V 7.88 3.72 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 0.11 0.00 0.00 -0.02 0.00 0.00 100 D 8.94 4.30 0.00 2.78 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 0.00 101 P 0.00 2.97 0.00 1.96 1.81 0.00 3.43 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.56 0.00 102 E 8.13 3.76 0.00 2.05 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 2.32 2.42 0.00 103 N 8.04 4.24 0.00 2.45 2.72 0.00 0.00 7.03 8.91 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 0.00 104 F 7.68 4.44 0.00 3.07 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 0.00 105 R 7.87 3.96 0.00 1.96 1.98 0.00 3.27 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.76 0.00 106 L 7.86 3.81 0.00 1.70 1.30 0.56 -0.08 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 L 8.28 4.09 0.00 1.89 1.89 0.94 1.13 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 0.00 108 G 8.37 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 0.00 0.00 0.00 109 N 8.23 4.48 0.00 2.83 2.95 0.00 0.00 6.66 7.73 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 0.00 110 V 7.99 3.61 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 1.15 0.00 0.00 1.18 0.00 0.00 111 L 8.17 3.90 0.00 1.75 1.77 0.94 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 112 V 7.92 3.64 2.33 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 1.29 0.00 0.00 1.18 0.00 0.00 113 C 8.07 4.12 0.00 3.15 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 0.00 114 V 7.83 3.52 2.16 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 0.95 0.00 0.00 0.96 0.00 0.00 115 L 7.85 3.95 0.00 0.97 1.30 0.74 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 0.00 116 A 7.12 3.57 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 0.00 117 H 8.14 3.92 0.00 3.14 3.51 0.00 5.77 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 H 8.28 3.88 0.00 2.76 2.90 0.00 5.99 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 F 8.37 4.54 0.00 3.37 3.16 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 0.00 120 G 8.04 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 0.00 0.00 0.00 121 K 8.80 4.24 0.00 1.91 2.00 0.00 1.60 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.51 7.81 122 Q 7.90 4.12 0.00 2.35 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.52 0.00 0.00 0.00 0.00 0.00 2.46 2.50 0.00 123 F 8.09 4.42 0.00 3.09 3.18 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 0.00 124 T 7.39 4.17 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 1.30 0.00 0.00 125 P 0.00 4.17 0.00 2.16 2.18 0.00 3.59 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 2.13 2.23 0.00 126 P 0.00 4.20 0.00 2.12 2.07 0.00 3.55 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.11 0.00 127 V 7.52 3.53 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 1.03 0.00 0.00 0.87 0.00 0.00 128 Q 7.71 3.62 0.00 1.87 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.46 0.00 0.00 0.00 0.00 0.00 2.43 2.60 0.00 129 A 8.36 3.97 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 0.00 130 A 8.00 3.95 1.36 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 0.00 131 Y 8.45 3.84 0.00 3.38 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 0.00 132 Q 8.91 4.10 0.00 2.27 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.77 0.00 0.00 0.00 0.00 0.00 2.72 2.62 0.00 133 K 8.12 3.91 0.00 1.96 1.83 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.59 7.81 134 V 7.44 3.50 2.07 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 0.66 0.00 0.00 0.69 0.00 0.00 135 V 8.28 3.91 2.44 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 0.92 0.00 0.00 1.02 0.00 0.00 136 A 8.24 4.12 1.42 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 0.00 0.00 137 G 8.16 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 0.00 138 V 8.33 3.28 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 0.49 0.00 0.00 0.76 0.00 0.00 139 A 7.90 3.89 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 0.00 140 N 8.39 4.30 0.00 2.64 2.89 0.00 0.00 7.10 7.28 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 0.00 141 A 8.41 4.17 1.49 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 0.00 142 L 8.30 3.82 0.00 0.93 0.35 -0.08 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 143 A 7.82 4.26 1.40 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 0.00 0.00 144 H 7.94 4.28 0.00 3.37 3.50 0.00 5.76 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 K 7.73 4.47 0.00 1.86 1.82 0.00 1.73 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.50 1.70 7.81 146 Y 8.10 4.11 0.00 3.12 2.97 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 0.00 147 H 8.24 4.46 0.00 3.22 3.24 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00