NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 E 4.1714 8.2876 120.2263 59.6077 30.7254 175.9572 4 E 3.4323 7.6977 114.7724 54.9065 29.3955 176.9635 5 K 3.9473 7.4475 119.9509 60.9182 33.9317 180.1208 6 K 4.1175 8.1369 118.8572 59.2485 32.8474 178.9534 7 R 3.7549 7.7384 120.3279 59.5964 29.7702 178.0427 8 R 3.9319 8.1607 117.2540 59.3705 29.8216 178.6058 9 A 3.9924 8.2164 119.5332 54.6118 18.7040 179.3070 10 A 4.0918 7.8701 119.4831 55.5070 18.5356 179.6950 11 T 3.7673 7.9353 107.4168 65.2494 68.6703 175.8391 12 A 4.0173 7.7071 124.3260 54.7738 18.1401 179.7676 13 R 3.9295 7.8220 115.8288 59.5960 30.0011 179.0844 14 R 3.8993 8.1142 117.1720 59.6838 30.0562 178.8581 15 Q 4.3221 8.1569 117.2542 59.3835 28.7711 178.0229 16 H 4.1029 8.8142 119.6572 59.5827 29.6765 177.1490 17 L 3.9260 8.6509 120.8389 57.6390 41.4875 179.2186 18 K 3.8441 8.8948 119.5567 59.8946 32.0689 179.3225 19 S 4.0863 8.6144 112.9359 60.9907 62.1941 175.8883 20 A 4.0141 7.6867 123.2498 54.9282 18.0656 179.3568 21 M 3.9775 8.3027 118.1718 58.2848 32.1741 178.4431 22 L 3.9110 8.2280 119.2450 58.2795 42.1023 179.3509 23 Q 3.9548 8.1453 119.0615 59.3538 28.7563 178.6782 24 L 4.0021 7.7357 120.3899 58.5072 42.1814 178.0085 25 A 3.8916 8.5265 120.5726 55.4031 18.0186 179.5389 26 V 3.5165 8.1008 115.7069 65.4751 31.1201 178.7340 27 T 3.8820 7.6170 112.1569 63.9074 67.1298 175.4737 28 E 4.2511 7.8879 120.9344 58.3299 29.9045 177.8905 29 I 3.6626 8.2417 119.5590 64.1730 38.0479 177.6674 30 E 4.0997 8.0130 118.0566 58.7355 29.4264 179.1778 31 K 3.9179 7.4097 120.2379 59.5016 32.1634 178.5818 32 E 3.8911 8.2378 119.2364 59.3710 29.4535 178.4686 33 A 3.9735 7.9418 120.0636 55.2669 18.4005 179.4386 34 A 3.8742 8.2582 118.2423 55.1810 18.3605 179.3719 35 A 3.9080 7.9908 118.3098 55.4684 18.6830 179.1174 36 K 3.8322 8.5157 118.0779 60.0035 32.1664 177.9367 37 E 3.8907 8.1849 119.0399 59.5605 29.5051 178.9690 38 V 3.6002 7.8809 117.9850 66.3769 31.4225 177.7303 39 E 4.0159 8.2181 117.9809 59.4198 29.3278 179.3094 40 K 3.9512 7.9399 119.0806 59.5884 32.3298 178.4669 41 Q 4.2213 8.3081 117.7071 57.9769 28.7840 178.1625 42 N 4.3657 8.0356 117.7062 56.1656 38.7619 176.3952 43 Y 4.0950 8.3006 121.2212 61.1273 38.7626 178.5657 44 L 4.1057 8.3015 119.0811 57.4187 41.4172 179.2068 45 A 3.9962 7.6381 120.7417 54.8174 18.3368 178.5954 46 E 4.2610 7.6119 113.3760 58.3279 30.7584 177.6190 47 H 4.3319 7.7078 114.9761 56.4814 30.1409 175.6208 48 S 4.7007 7.0775 110.3861 57.3071 64.5661 173.3789 49 P 4.4046 0.0000 0.0000 61.1537 32.2137 173.9704 50 P 4.1320 0.0000 0.0000 61.8404 30.5509 175.7499 51 L 3.9194 8.3330 124.6732 55.5672 42.3201 177.1982 52 S 4.4013 8.2029 118.1045 55.4791 63.1533 172.4900 53 L 3.9389 8.5059 126.2852 55.3149 40.4976 177.2859 54 P 4.6682 0.0000 0.0000 62.0761 33.0763 176.5807 55 G 4.0820 8.7751 111.5844 46.9754 0.0000 173.5983 56 S 4.6577 9.2207 114.6470 58.8417 68.3832 176.0967 57 M 4.2699 8.4842 120.0806 55.2993 30.4885 177.7817 58 Q 4.0706 9.4668 120.7175 58.9299 29.6376 175.1319 59 E 4.0550 8.2371 118.1170 59.6459 29.4247 178.7364 60 L 3.9226 7.9364 119.9093 57.2054 41.7048 179.6725 61 Q 3.9379 7.6680 116.1754 59.1059 28.7209 177.9043 62 E 3.8642 8.7988 120.8841 59.4434 29.6043 178.3012 63 L 3.8939 8.7266 120.4214 58.6328 42.1549 179.2777 64 S 4.1362 8.0815 114.6001 61.6456 62.8500 176.7868 65 K 3.9431 8.2537 122.3753 59.1984 31.9681 178.4057 66 K 3.8086 8.5471 120.2598 60.0497 32.0143 178.1083 67 L 3.9136 8.5066 119.1426 58.1525 41.7567 178.8334 68 H 3.9203 8.5867 117.4494 59.6833 29.8978 177.1435 69 A 4.1140 8.0770 122.1485 54.9560 18.2490 179.4214 70 K 3.8779 7.9308 118.1177 59.5784 32.1967 178.8055 71 I 3.7671 8.0958 120.5223 64.7972 37.1300 178.1154 72 D 4.5103 7.6503 118.1249 57.6391 40.5486 178.2847 73 S 4.1096 7.9583 113.7431 61.1254 62.3060 176.0938 74 V 3.6204 9.0047 121.6098 66.0177 31.3845 177.8819 75 D 4.3490 8.6234 118.0356 57.3334 41.1397 177.6153 76 E 3.9276 8.1822 119.7033 59.5662 29.4821 178.6735 77 E 3.9859 8.2345 118.2725 59.4581 29.4749 179.1863 78 R 3.8812 8.6085 119.3210 59.6162 30.0130 177.8236 79 Y 3.9154 8.4853 119.4176 60.8642 38.8911 177.4720 80 D 4.4839 8.8157 120.1148 57.9007 41.0104 179.1318 81 T 3.8128 8.1235 116.0365 66.7894 68.4346 176.0115 82 E 3.8370 8.2383 121.2048 59.5459 29.4626 179.1664 83 V 3.4296 7.6672 118.1722 65.7074 31.5618 178.1627 84 K 4.1303 8.0781 118.0891 58.5806 31.7970 179.2440 85 L 3.8602 7.8036 121.1647 58.1586 42.1080 178.4248 86 Q 3.9101 8.1115 118.3659 59.0694 28.6357 179.1653 87 K 3.8146 8.3133 120.5274 60.0167 32.1694 178.6601 88 T 3.8219 7.7778 115.5049 66.8887 68.4405 176.4416 89 I 3.6796 8.2698 121.8749 64.4594 37.1186 178.2945 90 K 3.8401 8.1167 120.1431 59.6350 32.0608 178.2309 91 E 3.9300 8.4604 120.1107 59.2949 29.4278 178.5032 92 L 4.2510 8.1343 118.7591 57.6829 40.6344 178.9788 93 E 3.9840 7.8525 119.5379 59.5212 29.6465 178.4119 94 D 4.5281 8.0509 118.8825 57.5175 40.7850 178.9809 95 L 4.0387 7.7583 119.0394 57.4052 41.3734 178.6000 96 S 4.6276 8.1550 110.7735 59.0060 62.3938 173.8976 97 Q 4.5649 7.6380 120.2638 58.4069 30.1543 177.0390 98 K 3.8674 7.9718 118.5622 58.4279 32.2075 176.8193 99 L 4.3892 8.1141 119.4557 57.2683 43.2084 177.2129 100 F 5.2607 8.5425 121.7314 60.5791 40.3131 175.1322 101 D 4.4554 8.0549 118.5683 51.2359 38.2534 175.3665 102 L 4.3556 6.9480 118.5002 56.3840 47.0315 173.9994 103 R 4.5315 8.2519 115.3011 58.6276 35.2764 174.9333 104 G 3.3334 7.4510 107.5697 44.2618 0.0000 172.3044 105 K 4.7303 8.4520 126.1453 56.0166 32.8936 176.6983 106 F 5.0960 7.7799 120.0710 54.3217 40.8201 175.0052 107 K 4.0392 8.6053 120.3804 57.3257 32.9306 177.1735 108 R 3.7810 8.4323 118.1501 56.9335 25.8171 174.9787 109 P 4.4527 0.0000 0.0000 61.4867 32.6047 176.6769 110 P 4.5976 0.0000 0.0000 65.7184 31.5362 177.7384 111 L 3.9330 8.0244 117.9148 55.5721 41.8542 176.3138 112 R 3.2693 7.1396 112.6195 56.9233 27.3268 175.6979 113 R 4.2269 8.2137 122.8560 54.9551 29.6040 175.7890 114 V 4.3668 8.0800 124.7650 59.7742 33.6307 175.8895 115 R 4.4549 8.2392 122.5779 54.4175 31.9277 175.6933 116 M 4.2676 8.1882 116.6952 54.8826 32.0506 177.1741 117 S 4.3128 8.4120 115.9877 58.2674 65.3840 175.3065 118 A 3.9473 8.4792 124.8350 55.3777 18.1851 179.6580 119 D 4.4701 8.1286 115.9739 57.1614 41.1889 178.3278 120 A 3.9110 8.0783 121.5893 55.3293 18.5568 179.0574 121 M 3.8762 8.1299 116.7835 58.8270 32.2675 178.3563 122 L 3.8689 8.3061 119.2239 57.7018 41.7749 179.4127 123 R 3.8136 7.8043 118.1838 59.5442 29.8631 178.0716 124 A 3.9670 8.3847 119.5750 55.3139 18.3519 178.9848 125 L 4.2807 7.8714 115.4496 55.9427 42.2482 178.1465 126 L 4.6360 7.8879 116.1081 51.2219 43.1934 179.0443 127 G 3.8827 8.8157 108.6417 46.2364 0.0000 174.8769 128 S 4.1492 9.3168 114.9299 61.4786 63.1999 176.3272 129 K 4.3121 7.6044 126.0538 54.8094 30.2662 175.6344 130 H 4.9002 7.7901 121.2064 53.7255 30.3270 172.5911 131 K 4.2384 7.7283 123.8867 53.4042 31.2174 174.4003 132 V 4.1515 7.1604 119.2438 61.4059 32.6814 174.8786 133 N 4.6995 8.4381 131.6469 51.4453 36.1623 175.8207 134 M 4.0039 7.7387 114.6660 57.4293 31.8692 174.5749 135 D 4.8599 8.2092 120.5092 53.4631 46.5471 174.4350 136 L 4.2297 7.8911 123.4238 54.7474 46.8434 173.1772 137 R 3.7279 7.7502 117.6026 56.1204 29.7294 176.1096 138 A 4.2858 8.2591 126.3093 51.5098 19.5752 175.4595 139 N 4.8772 8.3936 115.9210 52.0009 41.2417 173.3356 140 L 4.7621 7.9508 126.5604 53.2723 45.1520 175.5018 141 K 4.5378 8.0406 122.5991 54.7656 33.6064 173.9471 142 Q 4.0461 9.2569 126.8573 56.9417 27.7527 175.8875 143 V 3.9659 8.9579 115.8712 62.8708 31.6739 173.9221 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 3 E 8.29 4.17 0.00 2.01 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 0.00 2.30 2.25 0.00 4 E 7.70 3.43 0.00 2.34 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 2.30 2.42 0.00 5 K 7.45 3.95 0.00 1.93 2.00 0.00 1.62 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.44 1.53 7.81 6 K 8.14 4.12 0.00 1.97 2.10 0.00 1.56 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.49 1.43 7.81 7 R 7.74 3.75 0.00 1.87 2.08 0.00 3.11 0.00 0.00 3.17 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 8 R 8.16 3.93 0.00 1.93 1.98 0.00 3.23 0.00 0.00 3.34 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.77 0.00 9 A 8.22 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 10 A 7.87 4.09 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 11 T 7.94 3.77 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 12 A 7.71 4.02 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 13 R 7.82 3.93 0.00 2.12 2.00 0.00 3.36 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 14 R 8.11 3.90 0.00 2.03 2.02 0.00 3.13 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.76 0.00 15 Q 8.16 4.32 0.00 2.27 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.71 0.00 0.00 0.00 0.00 0.00 2.59 2.52 0.00 16 H 8.81 4.10 0.00 3.27 3.52 0.00 5.78 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 L 8.65 3.93 0.00 1.89 1.69 0.93 1.10 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 18 K 8.89 3.84 0.00 1.79 1.87 0.00 1.81 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.68 7.81 19 S 8.61 4.09 0.00 3.82 3.95 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 20 A 7.69 4.01 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 21 M 8.30 3.98 0.00 2.04 2.29 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.57 0.00 22 L 8.23 3.91 0.00 1.65 1.73 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 23 Q 8.15 3.95 0.00 2.31 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 24 L 7.74 4.00 0.00 1.96 1.78 0.92 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 25 A 8.53 3.89 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 26 V 8.10 3.52 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 0.99 0.00 0.00 0.93 0.00 0.00 27 T 7.62 3.88 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 1.29 0.00 0.00 28 E 7.89 4.25 0.00 2.25 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 0.00 2.27 2.35 0.00 29 I 8.24 3.66 2.09 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 1.58 1.18 0.98 0.00 0.00 30 E 8.01 4.10 0.00 2.18 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 2.49 2.34 0.00 31 K 7.41 3.92 0.00 2.13 1.89 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.96 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.46 1.71 7.81 32 E 8.24 3.89 0.00 2.05 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 0.00 2.31 2.34 0.00 33 A 7.94 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 34 A 8.26 3.87 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 35 A 7.99 3.91 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 36 K 8.52 3.83 0.00 2.10 1.98 0.00 1.55 0.00 0.00 1.56 0.00 0.00 3.00 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.51 7.81 37 E 8.18 3.89 0.00 2.13 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 2.32 2.40 0.00 38 V 7.88 3.60 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 0.99 0.00 0.00 1.03 0.00 0.00 39 E 8.22 4.02 0.00 2.21 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 2.35 2.63 0.00 40 K 7.94 3.95 0.00 1.81 2.02 0.00 1.70 0.00 0.00 2.03 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.52 7.81 41 Q 8.31 4.22 0.00 2.15 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.61 0.00 0.00 0.00 0.00 0.00 2.40 2.56 0.00 42 N 8.04 4.37 0.00 2.98 2.88 0.00 0.00 6.43 8.07 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 43 Y 8.30 4.09 0.00 3.11 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 44 L 8.30 4.11 0.00 1.85 1.78 0.99 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 45 A 7.64 4.00 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 46 E 7.61 4.26 0.00 1.95 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 2.28 2.04 0.00 47 H 7.71 4.33 0.00 2.85 3.21 0.00 5.69 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 48 S 7.08 4.70 0.00 3.72 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 49 P 0.00 4.40 0.00 2.06 1.94 0.00 3.75 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.19 0.00 50 P 0.00 4.13 0.00 2.03 2.08 0.00 3.69 0.00 0.00 3.58 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 51 L 8.33 3.92 0.00 1.60 1.60 0.92 0.90 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 52 S 8.20 4.40 0.00 3.80 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 53 L 8.51 3.94 0.00 1.79 1.71 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.67 0.00 2.06 2.08 0.00 3.69 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 2.03 2.09 0.00 55 G 8.78 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 0.00 0.00 0.00 0.00 56 S 9.22 4.66 0.00 3.93 3.90 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 0.00 0.00 0.00 57 M 8.48 4.27 0.00 2.26 1.87 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 2.65 2.59 0.00 58 Q 9.47 4.07 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.97 6.90 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 59 E 8.24 4.06 0.00 2.19 2.18 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 2.36 2.39 0.00 60 L 7.94 3.92 0.00 1.70 1.78 0.97 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 61 Q 7.67 3.94 0.00 2.32 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.73 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 62 E 8.80 3.86 0.00 2.30 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 0.00 2.31 2.38 0.00 63 L 8.73 3.89 0.00 1.80 1.73 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 64 S 8.08 4.14 0.00 4.15 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 65 K 8.25 3.94 0.00 1.80 1.96 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.43 7.81 66 K 8.55 3.81 0.00 1.86 1.99 0.00 1.59 0.00 0.00 1.65 0.00 0.00 3.03 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.55 7.81 67 L 8.51 3.91 0.00 1.83 1.69 0.93 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 68 H 8.59 3.92 0.00 3.28 3.52 0.00 5.58 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 69 A 8.08 4.11 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 70 K 7.93 3.88 0.00 2.00 1.93 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.49 7.81 71 I 8.10 3.77 2.00 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 1.51 0.47 0.87 0.00 0.00 72 D 7.65 4.51 0.00 2.92 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 73 S 7.96 4.11 0.00 3.93 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 74 V 9.00 3.62 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 0.97 0.00 0.00 1.00 0.00 0.00 75 D 8.62 4.35 0.00 2.90 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 76 E 8.18 3.93 0.00 2.23 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 0.00 2.34 2.32 0.00 77 E 8.23 3.99 0.00 2.27 2.01 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 2.36 2.54 0.00 78 R 8.61 3.88 0.00 1.99 2.16 0.00 3.11 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 79 Y 8.49 3.92 0.00 3.09 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 80 D 8.82 4.48 0.00 2.86 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 81 T 8.12 3.81 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 1.18 0.00 0.00 82 E 8.24 3.84 0.00 1.92 1.88 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 2.07 2.20 0.00 83 V 7.67 3.43 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 0.96 0.00 0.00 0.40 0.00 0.00 84 K 8.08 4.13 0.00 1.96 1.82 0.00 1.70 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.43 7.81 85 L 7.80 3.86 0.00 1.84 1.68 0.88 0.48 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 86 Q 8.11 3.91 0.00 2.23 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.52 0.00 0.00 0.00 0.00 0.00 2.33 2.60 0.00 87 K 8.31 3.81 0.00 1.90 1.95 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.49 7.81 88 T 7.78 3.82 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 1.20 0.00 0.00 89 I 8.27 3.68 1.97 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.62 0.90 0.00 0.00 90 K 8.12 3.84 0.00 2.01 2.05 0.00 1.54 0.00 0.00 1.56 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.49 7.81 91 E 8.46 3.93 0.00 2.05 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 2.31 2.34 0.00 92 L 8.13 4.25 0.00 1.99 1.91 0.96 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 93 E 7.85 3.98 0.00 2.16 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 0.00 2.34 2.58 0.00 94 D 8.05 4.53 0.00 2.89 2.73 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 95 L 7.76 4.04 0.00 1.81 1.70 0.92 1.30 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 96 S 8.16 4.63 0.00 4.10 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 97 Q 7.64 4.56 0.00 2.31 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.54 0.00 0.00 0.00 0.00 0.00 2.30 2.46 0.00 98 K 7.97 3.87 0.00 1.79 1.83 0.00 1.81 0.00 0.00 1.62 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.47 7.81 99 L 8.11 4.39 0.00 1.60 1.16 0.70 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 100 F 8.54 5.26 0.00 3.40 3.30 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 0.00 101 D 8.05 4.46 0.00 2.86 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 0.00 102 L 6.95 4.36 0.00 1.61 1.71 0.98 0.90 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 0.00 103 R 8.25 4.53 0.00 1.91 1.87 0.00 3.33 0.00 0.00 3.20 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.61 0.00 104 G 7.45 3.33 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 0.00 105 K 8.45 4.73 0.00 1.89 1.79 0.00 1.72 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.33 1.39 7.81 106 F 7.78 5.10 0.00 3.21 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 0.00 107 K 8.61 4.04 0.00 1.84 1.83 0.00 1.83 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.47 1.53 7.81 108 R 8.43 3.78 0.00 2.01 2.02 0.00 3.38 0.00 0.00 3.24 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 109 P 0.00 4.45 0.00 2.04 1.73 0.00 3.48 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.52 0.00 110 P 0.00 4.60 0.00 2.21 2.24 0.00 3.89 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.08 0.00 111 L 8.02 3.93 0.00 1.64 1.74 0.94 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 112 R 7.14 3.27 0.00 1.96 1.91 0.00 3.30 0.00 0.00 3.13 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.67 0.00 113 R 8.21 4.23 0.00 1.73 1.83 0.00 3.14 0.00 0.00 3.25 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 114 V 8.08 4.37 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 0.82 0.00 0.00 0.92 0.00 0.00 115 R 8.24 4.45 0.00 1.80 1.90 0.00 3.19 0.00 0.00 3.26 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 116 M 8.19 4.27 0.00 2.11 2.06 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.51 0.00 117 S 8.41 4.31 0.00 4.07 4.03 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 0.00 118 A 8.48 3.95 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 0.00 119 D 8.13 4.47 0.00 2.83 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 0.00 120 A 8.08 3.91 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 0.00 121 M 8.13 3.88 0.00 2.18 2.07 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 2.58 2.57 0.00 122 L 8.31 3.87 0.00 1.71 1.13 0.91 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 123 R 7.80 3.81 0.00 1.95 2.08 0.00 3.14 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 124 A 8.38 3.97 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 0.00 125 L 7.87 4.28 0.00 1.69 1.71 0.90 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 126 L 7.89 4.64 0.00 1.60 1.68 0.91 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.82 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 0.00 128 S 9.32 4.15 0.00 3.99 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 0.00 129 K 7.60 4.31 0.00 1.73 1.79 0.00 1.62 0.00 0.00 1.64 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.50 7.81 130 H 7.79 4.90 0.00 3.04 3.14 0.00 5.95 0.00 0.00 0.00 0.00 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 K 7.73 4.24 0.00 1.72 1.68 0.00 1.85 0.00 0.00 1.61 0.00 0.00 2.69 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.30 1.32 7.81 132 V 7.16 4.15 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 0.81 0.00 0.00 0.93 0.00 0.00 133 N 8.44 4.70 0.00 2.86 2.86 0.00 0.00 6.26 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 0.00 134 M 7.74 4.00 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.77 0.00 135 D 8.21 4.86 0.00 2.76 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 0.00 136 L 7.89 4.23 0.00 1.56 1.64 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 137 R 7.75 3.73 0.00 1.96 1.95 0.00 3.38 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.80 0.00 138 A 8.26 4.29 1.25 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 0.00 0.00 139 N 8.39 4.88 0.00 2.60 2.66 0.00 0.00 6.58 7.78 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 0.00 140 L 7.95 4.76 0.00 1.56 1.47 0.92 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 141 K 8.04 4.54 0.00 1.78 1.69 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.55 7.81 142 Q 9.26 4.05 0.00 2.01 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.85 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 143 V 8.96 3.97 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 0.84 0.00 0.00 0.93 0.00 0.00