NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2645 8.3001 120.3267 55.0073 33.2934 175.3699 2 A 4.0498 8.4487 125.1282 51.2274 17.4717 174.1929 3 E 4.6796 8.4959 126.2385 56.8469 31.5918 176.7363 4 V 3.6535 7.7942 118.9209 65.1436 31.2771 176.5400 5 I 3.7844 7.7011 112.6336 63.5466 37.3108 177.9100 6 K 3.8081 7.5809 120.0800 59.2269 31.8495 178.7519 7 S 4.1271 7.3875 112.5852 61.0882 62.3945 175.9152 8 I 3.9415 7.7032 122.5794 64.5131 36.9177 178.2054 9 M 4.2090 7.6803 119.1260 58.1369 31.5781 178.6254 10 R 4.0761 7.9579 118.8946 58.1926 30.0069 177.4622 11 K 4.3258 7.5635 116.1529 55.9162 32.3925 175.7036 12 F 4.7536 7.7956 122.9218 55.5112 39.6026 173.4449 13 P 4.5256 0.0000 0.0000 62.7719 32.0397 175.8115 14 L 4.7304 8.8264 122.5521 52.5633 45.9128 176.3591 15 G 4.1205 8.7749 109.8103 46.5142 0.0000 172.6762 16 V 4.8782 8.2842 114.5506 59.6129 35.1912 174.3765 17 A 4.6661 8.4813 123.0370 51.2512 23.6159 175.0348 18 I 4.6523 8.1859 119.3769 59.6728 40.2931 175.4694 19 V 4.5618 8.0577 121.2070 59.8614 33.3647 175.4407 20 T 5.2856 8.8156 115.2262 60.5554 72.4492 172.5343 21 T 5.0468 8.9033 115.9423 61.3056 71.9017 171.8408 22 N 4.7369 8.8008 122.7843 51.7709 39.5815 174.2665 23 W 4.6894 9.0979 135.0000 56.2834 30.3476 175.4954 24 K 3.9917 9.5554 128.4296 57.0188 29.1152 176.0997 25 G 3.9753 8.6592 107.3682 45.3700 0.0000 173.6374 26 E 4.0466 7.8158 121.4776 55.2029 29.8360 175.4308 27 L 4.4390 8.2406 127.1303 54.4447 42.2112 176.6219 28 V 4.9596 8.4672 116.6300 59.9756 36.0074 174.8704 29 G 4.8422 8.9953 108.9184 45.9724 0.0000 171.6853 30 M 5.3365 8.7204 116.0914 53.9896 34.6889 174.3547 31 T 4.5848 8.9635 118.8818 64.0219 69.9451 173.9103 32 V 4.5409 8.9706 119.3578 59.0898 35.8809 175.8000 33 N 5.1414 8.9789 119.5182 52.0146 37.7246 174.6871 34 T 4.4194 7.6921 106.1707 61.7444 70.4242 172.9301 35 F 4.7811 8.2078 124.9845 58.8395 40.1624 173.6224 36 N 4.3813 7.7260 122.6959 52.3211 43.0914 172.8395 37 S 4.3619 8.2919 117.3407 58.1239 62.4677 173.1287 38 L 4.5057 8.3912 128.7491 56.5275 43.7492 176.3146 39 S 4.5468 7.6695 110.3829 57.6016 65.0807 175.4233 40 L 4.2468 8.6765 124.9564 55.4759 42.8388 175.9921 41 N 4.7333 7.7311 115.6444 50.7255 40.1521 171.8069 42 P 4.3973 0.0000 0.0000 61.5069 32.3567 175.2069 43 P 4.6934 0.0000 0.0000 62.8012 31.3305 174.2596 44 L 5.1202 8.5698 126.6071 53.3130 44.4791 176.0406 45 V 5.0077 8.6763 115.3622 59.8910 35.9846 174.4827 46 S 5.8425 8.9575 115.6933 57.7184 66.9102 172.5731 47 F 5.4895 8.0190 113.9057 55.7423 41.5491 172.5676 48 F 5.5965 8.8889 118.1796 55.8617 40.7147 175.2944 49 A 4.8338 8.8730 125.6195 49.8171 21.8129 174.8822 50 D 4.0895 8.6234 122.7931 54.2351 41.8671 177.2989 51 R 4.3527 8.8191 125.9152 58.6976 30.6621 179.1113 52 M 4.0410 8.2143 116.6905 58.3969 31.9630 177.5649 53 K 4.0916 8.1210 114.9726 56.7304 32.1834 177.8529 54 G 3.9300 8.1577 107.6908 46.6707 0.0000 175.5849 55 N 4.5265 8.1727 118.9053 55.4546 38.4572 176.6878 56 D 4.5683 8.0204 120.7890 56.1524 39.2939 178.3547 57 I 3.5857 7.2513 120.1076 63.8203 36.9195 176.2582 58 P 2.9700 0.0000 0.0000 65.3319 30.6732 177.8216 59 Y 4.2706 7.2645 114.4526 60.5660 37.8350 177.8937 60 K 4.1452 8.0475 118.5358 58.3897 32.0942 177.5294 61 E 4.6767 7.4644 115.9439 55.8754 30.0032 175.4070 62 S 4.9469 7.5931 113.5853 56.7339 66.6399 173.9388 63 K 4.2182 8.4697 120.1186 57.8526 33.4594 176.0728 64 Y 5.5505 7.6951 115.1221 56.3795 42.0392 174.8014 65 F 5.2824 8.8036 113.2734 56.2503 41.6440 173.1941 66 V 4.8972 9.0299 120.7263 61.2666 34.5922 174.2698 67 V 4.1853 8.7423 127.4891 61.2723 33.3533 173.8701 68 N 4.9640 8.5820 126.1500 51.4489 40.9759 173.7350 69 F 4.7559 8.4679 122.7783 55.9039 40.9918 174.8895 70 T 4.5961 8.1762 117.2365 60.1815 70.8125 172.6436 71 D 5.0647 8.7578 121.8243 52.9446 40.1094 175.3232 72 N 4.6890 7.7526 119.5493 52.4280 38.9177 174.9886 73 E 3.9532 8.8628 127.0050 59.7340 29.4872 178.9711 74 E 3.9479 8.2680 118.5480 59.2378 29.6897 178.7835 75 L 4.0159 7.7141 119.0175 57.6700 41.6226 179.3820 76 F 4.4729 7.5360 118.6331 60.1690 38.8806 177.3233 77 N 4.6001 8.1781 115.7206 56.2401 38.1867 177.6125 78 I 3.6518 7.8141 121.3950 63.8902 37.0317 177.4638 79 F 4.5510 8.2263 116.5207 57.2005 38.6814 176.9450 80 A 4.6053 7.6417 120.8911 51.8604 20.9419 177.7707 81 L 4.6563 7.9306 113.6031 55.1429 44.1872 177.4421 82 K 4.2648 7.4598 117.4990 54.4946 33.0104 175.0748 83 P 4.3281 0.0000 0.0000 62.8046 32.0552 177.4318 84 V 3.5729 8.5796 120.5309 66.0010 31.4755 177.8352 85 K 4.2484 7.9869 116.5641 58.2141 32.9882 176.8375 86 E 4.3740 8.0886 120.1725 56.8049 30.9695 177.8416 87 R 3.4474 7.5340 117.3061 59.4304 29.9564 178.2138 88 F 4.5539 7.9303 112.1740 57.9325 39.3643 176.8569 89 R 4.2198 7.7207 120.8427 58.5429 30.0869 177.4509 90 E 4.3172 7.6186 114.4831 56.6885 30.0479 175.8126 91 I 4.6530 7.5323 113.1014 59.0765 40.9972 175.1622 92 K 4.5871 8.4004 124.5267 54.8038 32.8624 175.9973 93 Y 5.4853 8.2406 121.9093 54.5914 41.3576 174.0615 94 K 4.6035 8.8862 119.2565 55.0595 36.4128 174.9259 95 E 4.6128 8.6246 120.0586 55.8298 31.2914 175.9558 96 G 4.0810 8.6026 112.5105 44.3652 0.0000 171.8299 97 I 3.6598 8.6336 122.7154 62.1666 38.2504 177.2822 98 G 4.0116 9.2504 115.2454 46.4420 0.0000 174.6017 99 G 4.2149 8.0690 107.2659 44.7241 0.0000 174.5243 100 C 4.3225 7.7304 118.2801 59.4972 29.1998 171.4284 101 P 5.0372 0.0000 0.0000 62.7396 32.2777 175.3669 102 I 4.4488 8.6113 124.4405 59.3997 39.4009 175.0051 103 L 4.5399 8.8088 127.5792 54.6278 42.1608 177.9022 104 Y 4.0174 8.6966 124.8942 60.8078 38.9282 176.3275 105 D 4.6180 8.0533 116.4531 54.5306 40.8880 176.3610 106 S 4.2835 7.4469 116.4070 58.5536 63.5575 173.8466 107 Y 4.5917 7.9176 121.0386 58.0997 39.3430 174.7275 108 A 5.1742 7.3398 120.2190 51.6449 22.7390 174.3920 109 Y 5.4391 8.1565 116.3735 55.9694 42.3334 173.7348 110 I 4.9466 8.8483 120.2912 59.7046 40.9179 174.5622 111 E 4.9815 9.0328 126.2074 55.2665 31.6596 175.0853 112 A 5.0481 8.5599 123.5519 50.4423 23.5494 174.6067 113 K 5.0549 8.8021 121.2315 54.0676 34.7095 175.4165 114 L 4.4424 8.8133 130.1032 56.3108 42.0234 175.7250 115 Y 4.6537 8.5850 125.4562 58.9603 41.4549 174.6112 116 D 4.6379 7.7886 115.4808 53.8961 44.6555 174.5055 117 T 5.5939 8.3014 111.0042 59.3638 72.3811 173.4198 118 I 4.5096 7.9778 122.9137 60.1846 41.5740 173.6012 119 D 4.9560 8.7563 127.8404 53.3805 41.9674 176.3529 120 V 4.1839 8.4694 123.8838 61.4951 34.4951 174.7068 121 G 3.7028 8.4541 117.9861 47.2781 0.0000 173.1917 122 D 4.7530 8.5791 124.2020 53.5063 39.7737 175.2606 123 H 5.4194 8.0991 116.1638 54.5223 33.3134 172.3574 124 S 5.1458 8.8367 115.8155 56.8894 66.3071 173.4386 125 I 4.6210 8.5135 124.7829 60.5652 38.6694 174.7230 126 I 4.4392 8.3423 128.7982 59.5015 39.2229 174.7130 127 V 4.9233 8.5837 127.6737 61.0763 33.9003 174.6327 128 G 4.6408 9.3062 114.4267 44.2519 0.0000 171.3030 129 E 4.6117 9.3156 125.2619 55.1227 30.6791 176.1155 130 V 4.0706 8.5917 128.6272 63.3071 31.6071 175.5861 131 I 4.6534 8.5691 119.5947 61.3834 40.0775 174.4168 132 D 4.5534 7.7395 120.4265 52.5807 42.9855 174.1193 133 G 4.1609 7.3009 102.4754 45.6021 0.0000 172.6100 134 Y 4.7556 7.8263 119.3383 55.8530 42.5310 174.0419 135 Q 4.5349 8.7570 124.1378 55.4001 29.8186 174.0150 136 I 4.3108 8.7331 126.9683 62.6718 38.3446 175.8541 137 R 4.5131 7.9053 121.1259 55.1992 31.3139 175.7482 138 D 4.5579 8.9240 126.4619 56.1989 41.7258 176.7131 139 N 4.6398 8.0572 116.3216 50.4662 37.8006 176.3955 140 F 5.0299 7.4376 117.7204 54.7959 41.0811 174.5122 141 T 4.4266 8.4446 117.6684 60.7671 68.7917 172.6273 142 P 4.7755 0.0000 0.0000 62.6158 32.2208 175.9248 143 L 5.2923 8.5875 119.7688 53.2411 44.9705 176.1023 144 V 4.7351 8.5546 114.1648 59.7880 35.9865 173.9659 145 Y 4.7654 9.0286 126.0388 56.8401 40.5295 174.0940 146 M 4.5059 8.4822 125.7228 54.6426 36.3312 174.0246 147 N 4.3290 8.5540 125.0073 55.0291 37.7910 174.5982 148 R 4.3152 7.4780 110.7782 56.2632 28.0433 175.9981 149 K 4.6672 7.0557 116.2765 54.7535 36.8495 174.5087 150 Y 5.2353 8.3928 118.4186 56.5632 40.5793 174.9841 151 Y 4.8371 8.9686 120.9112 55.9407 41.6376 175.7704 152 K 4.6738 8.8368 122.1243 56.2247 33.6113 176.1847 153 L 4.4597 8.2938 121.5650 53.7013 42.7602 177.1493 154 S 4.3090 8.6142 117.0095 58.5001 62.3629 173.4899 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 M 8.30 4.26 0.00 2.00 2.07 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.61 0.00 2 A 8.45 4.05 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 3 E 8.50 4.68 0.00 2.04 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 2.29 2.33 0.00 4 V 7.79 3.65 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 1.03 0.00 0.00 0.93 0.00 0.00 5 I 7.70 3.78 1.86 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 1.62 0.65 0.90 0.00 0.00 6 K 7.58 3.81 0.00 2.03 1.85 0.00 1.65 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.46 1.53 7.81 7 S 7.39 4.13 0.00 3.83 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 8 I 7.70 3.94 1.85 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 1.51 0.85 0.87 0.00 0.00 9 M 7.68 4.21 0.00 2.06 2.28 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.87 0.00 10 R 7.96 4.08 0.00 2.01 1.92 0.00 3.29 0.00 0.00 3.17 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.69 0.00 11 K 7.56 4.33 0.00 1.76 1.81 0.00 1.74 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.55 1.51 7.81 12 F 7.80 4.75 0.00 3.03 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 P 0.00 4.53 0.00 1.89 1.82 0.00 3.21 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 1.57 1.78 0.00 14 L 8.83 4.73 0.00 1.64 1.57 1.10 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 15 G 8.77 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 0.00 0.00 0.00 16 V 8.28 4.88 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 0.58 0.00 0.00 0.29 0.00 0.00 17 A 8.48 4.67 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 I 8.19 4.65 1.42 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.65 0.11 0.00 0.00 19 V 8.06 4.56 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 -0.06 0.00 0.00 20 T 8.82 5.29 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 1.15 0.00 0.00 21 T 8.90 5.05 4.57 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 0.93 0.00 0.00 22 N 8.80 4.74 0.00 2.77 2.88 0.00 0.00 6.75 7.95 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 23 W 9.10 4.69 0.00 3.15 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 K 9.56 3.99 0.00 1.51 1.66 0.00 1.50 0.00 0.00 1.46 0.00 0.00 3.25 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.31 1.42 7.81 25 G 8.66 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 26 E 7.82 4.05 0.00 1.84 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.24 0.00 27 L 8.24 4.44 0.00 0.95 0.13 0.16 0.65 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 28 V 8.47 4.96 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 0.96 0.00 0.00 0.88 0.00 0.00 29 G 9.00 4.84 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 30 M 8.72 5.34 0.00 2.19 2.18 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.57 0.00 31 T 8.96 4.58 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 32 V 8.97 4.54 2.04 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 0.71 0.00 0.00 0.78 0.00 0.00 33 N 8.98 5.14 0.00 2.75 2.66 0.00 0.00 6.18 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 34 T 7.69 4.42 3.56 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 1.31 0.00 0.00 35 F 8.21 4.78 0.00 2.98 3.02 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 36 N 7.73 4.38 0.00 2.56 2.37 0.00 0.00 6.58 6.91 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 37 S 8.29 4.36 0.00 3.87 3.69 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 38 L 8.39 4.51 0.00 1.65 1.77 0.94 0.70 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 39 S 7.67 4.55 0.00 3.87 3.56 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 40 L 8.68 4.25 0.00 1.64 1.67 0.91 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 41 N 7.73 4.73 0.00 2.60 2.67 0.00 0.00 6.99 7.69 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 42 P 0.00 4.40 0.00 2.07 1.98 0.00 3.77 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 1.79 1.90 0.00 43 P 0.00 4.69 0.00 2.11 2.24 0.00 3.60 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.96 0.00 44 L 8.57 5.12 0.00 1.53 1.49 0.55 -0.12 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 45 V 8.68 5.01 2.27 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 0.90 0.00 0.00 1.34 0.00 0.00 46 S 8.96 5.84 0.00 3.95 3.94 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 47 F 8.02 5.49 0.00 3.05 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 48 F 8.89 5.60 0.00 2.98 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 49 A 8.87 4.83 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 D 8.62 4.09 0.00 2.68 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 R 8.82 4.35 0.00 1.90 1.93 0.00 3.16 0.00 0.00 3.32 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 52 M 8.21 4.04 0.00 2.01 2.24 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.51 0.00 53 K 8.12 4.09 0.00 1.80 1.87 0.00 1.81 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.49 1.54 7.81 54 G 8.16 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 N 8.17 4.53 0.00 3.00 3.01 0.00 0.00 6.89 7.44 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 56 D 8.02 4.57 0.00 2.85 2.90 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 I 7.25 3.59 1.65 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 1.51 0.83 0.95 0.00 0.00 58 P 0.00 2.97 0.00 0.70 1.03 0.00 3.31 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 1.47 0.79 0.00 59 Y 7.26 4.27 0.00 3.00 3.05 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 60 K 8.05 4.15 0.00 1.86 1.88 0.00 1.74 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.58 7.81 61 E 7.46 4.68 0.00 2.10 2.15 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 2.33 2.43 0.00 62 S 7.59 4.95 0.00 3.96 3.85 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 63 K 8.47 4.22 0.00 1.24 1.12 0.00 1.48 0.00 0.00 1.67 0.00 0.00 2.81 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.27 7.81 64 Y 7.70 5.55 0.00 2.89 2.88 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 65 F 8.80 5.28 0.00 3.43 3.42 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 66 V 9.03 4.90 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 1.04 0.00 0.00 0.97 0.00 0.00 67 V 8.74 4.19 1.71 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 -0.54 0.00 0.00 1.02 0.00 0.00 68 N 8.58 4.96 0.00 2.37 2.40 0.00 0.00 6.44 7.92 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 69 F 8.47 4.76 0.00 2.46 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 0.00 0.00 0.00 0.00 70 T 8.18 4.60 3.92 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 0.55 0.00 0.00 71 D 8.76 5.06 0.00 3.06 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 72 N 7.75 4.69 0.00 2.75 2.62 0.00 0.00 7.20 9.00 0.00 0.00 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 E 8.86 3.95 0.00 2.00 1.82 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 2.43 2.40 0.00 74 E 8.27 3.95 0.00 2.01 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 2.34 2.38 0.00 75 L 7.71 4.02 0.00 1.52 1.44 0.77 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 76 F 7.54 4.47 0.00 2.92 2.98 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 77 N 8.18 4.60 0.00 2.91 2.89 0.00 0.00 7.01 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 78 I 7.81 3.65 1.89 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.78 0.24 0.00 0.00 79 F 8.23 4.55 0.00 3.13 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 80 A 7.64 4.61 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 81 L 7.93 4.66 0.00 1.70 1.69 1.06 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 82 K 7.46 4.26 0.00 1.66 1.61 0.00 1.77 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.25 7.81 83 P 0.00 4.33 0.00 2.20 2.18 0.00 3.66 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.95 0.00 84 V 8.58 3.57 2.13 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 1.11 0.00 0.00 0.99 0.00 0.00 85 K 7.99 4.25 0.00 1.92 1.93 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.42 7.81 86 E 8.09 4.37 0.00 2.03 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 2.17 2.28 0.00 87 R 7.53 3.45 0.00 1.67 0.75 0.00 3.03 0.00 0.00 2.66 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.47 0.00 88 F 7.93 4.55 0.00 2.99 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 89 R 7.72 4.22 0.00 1.76 2.01 0.00 3.16 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.64 0.00 90 E 7.62 4.32 0.00 1.92 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 2.26 2.39 0.00 91 I 7.53 4.65 1.93 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.05 0.89 0.00 0.00 92 K 8.40 4.59 0.00 1.47 1.72 0.00 1.76 0.00 0.00 1.87 0.00 0.00 2.84 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.41 1.00 7.81 93 Y 8.24 5.49 0.00 3.13 3.08 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 94 K 8.89 4.60 0.00 1.78 1.88 0.00 1.25 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.25 1.30 7.81 95 E 8.62 4.61 0.00 1.96 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 0.00 2.56 2.38 0.00 96 G 8.60 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 97 I 8.63 3.66 1.82 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 0.49 0.35 0.61 0.00 0.00 98 G 9.25 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 99 G 8.07 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 0.00 0.00 0.00 0.00 100 C 7.73 4.32 0.00 3.04 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 0.00 101 P 0.00 5.04 0.00 2.14 1.65 0.00 3.70 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.28 0.00 102 I 8.61 4.45 1.63 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.23 0.68 0.32 0.00 0.00 103 L 8.81 4.54 0.00 1.46 1.52 0.44 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 104 Y 8.70 4.02 0.00 2.91 3.09 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 0.00 105 D 8.05 4.62 0.00 2.72 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 0.00 106 S 7.45 4.28 0.00 3.81 3.94 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 0.00 107 Y 7.92 4.59 0.00 2.83 3.11 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 0.00 108 A 7.34 5.17 1.23 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 0.00 0.00 109 Y 8.16 5.44 0.00 3.16 2.96 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 0.00 0.00 0.00 110 I 8.85 4.95 2.06 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.05 1.02 0.00 0.00 111 E 9.03 4.98 0.00 2.20 1.87 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 2.57 2.65 0.00 112 A 8.56 5.05 0.75 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 0.00 0.00 113 K 8.80 5.05 0.00 2.03 1.74 0.00 1.76 0.00 0.00 1.64 0.00 0.00 2.78 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.20 7.81 114 L 8.81 4.44 0.00 1.82 1.63 1.18 1.03 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 0.00 115 Y 8.59 4.65 0.00 3.06 3.11 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 0.00 116 D 7.79 4.64 0.00 2.66 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 0.00 117 T 8.30 5.59 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 1.22 0.00 0.00 118 I 7.98 4.51 1.83 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 1.41 0.69 0.88 0.00 0.00 119 D 8.76 4.96 0.00 2.53 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 0.00 120 V 8.47 4.18 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 0.90 0.00 0.00 0.84 0.00 0.00 121 G 8.45 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 D 8.58 4.75 0.00 2.93 2.90 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 0.00 123 H 8.10 5.42 0.00 2.99 3.10 0.00 5.76 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 S 8.84 5.15 0.00 3.66 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 0.00 125 I 8.51 4.62 1.85 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.68 1.05 0.00 0.00 126 I 8.34 4.44 0.56 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.48 0.58 0.00 0.00 127 V 8.58 4.92 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 1.09 0.00 0.00 1.02 0.00 0.00 128 G 9.31 4.64 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 0.00 129 E 9.32 4.61 0.00 2.09 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 2.25 2.02 0.00 130 V 8.59 4.07 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 0.80 0.00 0.00 1.01 0.00 0.00 131 I 8.57 4.65 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.86 1.04 0.00 0.00 132 D 7.74 4.55 0.00 2.50 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 0.00 133 G 7.30 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 0.00 134 Y 7.83 4.76 0.00 2.58 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 0.00 135 Q 8.76 4.53 0.00 2.07 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.87 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 136 I 8.73 4.31 2.06 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.83 0.91 0.00 0.00 137 R 7.91 4.51 0.00 1.82 1.96 0.00 3.29 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.70 0.00 138 D 8.92 4.56 0.00 2.69 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 0.00 139 N 8.06 4.64 0.00 2.73 2.63 0.00 0.00 6.42 7.43 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 0.00 140 F 7.44 5.03 0.00 2.92 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 0.00 141 T 8.44 4.43 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 1.27 0.00 0.00 142 P 0.00 4.78 0.00 2.35 2.35 0.00 3.71 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.04 0.00 143 L 8.59 5.29 0.00 1.74 1.81 1.26 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 144 V 8.55 4.74 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 0.73 0.00 0.00 1.02 0.00 0.00 145 Y 9.03 4.77 0.00 2.77 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 0.00 146 M 8.48 4.51 0.00 1.91 1.65 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.40 0.00 147 N 8.55 4.33 0.00 2.88 2.84 0.00 0.00 7.31 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 0.00 148 R 7.48 4.32 0.00 1.97 2.08 0.00 3.30 0.00 0.00 3.97 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 149 K 7.06 4.67 0.00 1.67 1.17 0.00 1.42 0.00 0.00 1.55 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.23 1.42 7.81 150 Y 8.39 5.24 0.00 2.81 2.88 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 0.00 151 Y 8.97 4.84 0.00 2.83 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 0.00 152 K 8.84 4.67 0.00 1.69 1.82 0.00 1.68 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.50 1.61 7.81 153 L 8.29 4.46 0.00 1.65 1.61 0.94 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 154 S 8.61 4.31 0.00 3.84 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