NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8054 8.3393 109.7266 45.3045 0.0000 172.9448 2 I 3.9505 7.9233 114.0988 59.2938 38.9183 173.4721 3 S 4.6332 8.6407 116.4341 56.2011 67.2432 175.1723 4 Y 4.1817 8.5008 120.3692 59.0375 37.8883 176.8441 5 S 4.6250 8.9290 118.1956 58.1718 63.7488 174.1335 6 V 4.4626 7.3603 119.7844 60.8469 34.3444 174.8290 7 E 4.1080 8.6586 125.0086 56.4328 29.9929 176.5112 8 A 4.3946 8.0707 124.1130 50.3593 21.9051 175.3968 9 D 4.4685 8.6953 123.5348 53.1452 41.1463 174.8055 10 P 4.3290 0.0000 0.0000 65.9738 31.2000 177.5218 11 D 4.6173 8.6597 118.3485 56.6950 41.1304 176.7699 12 T 5.2518 8.1719 108.5910 60.2182 70.3916 173.2871 13 T 4.9529 8.1395 114.0894 61.1719 70.9966 172.5358 14 A 4.8044 8.7771 126.6099 50.1818 22.7511 175.2716 15 K 5.1478 8.3732 118.7983 54.9438 36.2967 174.9200 16 A 4.7237 8.7588 120.5378 52.1062 22.9474 175.2907 17 M 5.1734 8.4914 117.2763 54.1738 36.4410 174.3640 18 L 4.8297 8.6407 120.8880 53.0941 45.1481 175.7424 19 R 4.8252 8.2006 119.6408 55.2282 33.5645 175.3548 20 E 3.7537 9.4083 122.8917 57.0903 28.1161 175.7971 21 R 4.0051 8.1882 118.1059 56.6155 31.4899 177.2719 22 Q 5.2661 8.9359 123.5564 54.1723 27.8073 174.3546 23 M 4.8420 7.9554 119.6946 53.3009 35.2805 174.7080 24 S 4.0787 8.6446 113.8063 58.4794 63.1071 174.5799 25 F 4.3985 8.9562 129.7709 61.4039 38.7789 177.2488 26 K 3.5117 7.8680 117.6522 59.6144 31.7130 178.8969 27 H 4.0532 8.4900 116.9548 58.7284 28.5881 177.9626 28 S 4.1941 7.8006 116.6928 61.5702 62.6814 176.8563 29 K 3.7858 7.6949 120.8831 59.2209 31.7280 179.2223 30 A 3.8144 7.3202 120.1099 55.1380 18.3040 179.8333 31 I 3.4667 7.7019 118.0983 64.2825 37.1015 178.2342 32 A 3.9653 7.9877 121.9704 55.4498 18.0086 179.3161 33 R 3.7379 7.7019 115.5195 59.9333 30.0720 177.9051 34 E 3.9466 7.7935 117.9572 58.6062 29.9254 178.0103 35 I 3.8783 7.7514 112.0500 60.7704 38.3145 175.7908 36 K 3.9415 7.1807 122.1587 58.1528 32.3803 176.4248 37 G 3.9992 8.8886 113.9958 45.5382 0.0000 173.9335 38 K 4.3541 7.8115 119.2300 56.0567 33.2130 176.0050 39 T 4.6919 9.4641 117.3269 62.4063 70.7831 175.9344 40 A 4.1148 8.6917 126.6943 55.7460 18.4515 180.7545 41 G 3.6057 8.1204 103.8644 47.9910 0.0000 175.7826 42 E 4.0259 8.0924 120.1755 59.0054 29.5911 178.9605 43 A 4.0523 8.4186 121.2845 55.1923 18.4286 179.6479 44 V 3.5640 7.9678 116.6488 66.5168 31.6427 177.8516 45 D 4.3820 8.1950 118.4138 57.4794 40.4941 178.2495 46 Y 4.0879 8.4312 120.2220 60.9222 38.8760 178.2971 47 L 3.8225 8.5402 120.1653 57.7772 41.6209 179.4656 48 E 3.9617 8.4839 118.5831 59.2560 29.3012 179.1939 49 A 3.9592 7.9445 120.7881 54.5983 18.3554 180.0313 50 V 4.0851 7.2974 118.5255 65.9281 31.4459 178.3766 51 I 3.7354 7.5621 118.1125 64.2426 36.9685 177.6648 52 E 4.1005 8.1935 119.1625 57.1492 29.5024 177.5581 53 G 3.4145 7.8054 106.2412 45.5610 0.0000 173.6864 54 D 4.5901 8.0237 118.8639 54.3469 41.9031 176.4556 55 Q 4.4957 7.7198 120.6030 53.4995 31.6235 171.9590 56 P 4.4687 0.0000 0.0000 62.1570 33.2930 175.3805 57 V 4.5014 8.5890 122.5311 59.9095 33.1104 173.3983 58 P 4.8306 0.0000 0.0000 63.4275 31.8521 176.5446 59 F 4.8558 9.2539 124.5971 56.1797 38.1708 175.4736 60 K 3.6047 8.3535 122.8915 57.2485 32.8139 177.6075 61 Q 4.2937 7.9496 117.1706 57.7686 30.6447 176.0733 62 H 4.6762 7.6056 115.8831 54.3048 27.4034 174.3847 63 N 5.1871 7.8967 115.3334 52.0473 38.3404 175.2325 64 S 4.3770 8.1082 114.4269 59.8951 63.3637 174.7815 65 G 3.9564 8.9622 112.9308 45.3161 0.0000 173.5939 66 V 3.7302 7.5273 120.3655 62.4443 31.8074 175.9129 67 G 3.8464 8.4354 114.1669 46.2126 0.0000 172.7160 68 H 4.9024 8.6236 119.1374 55.6445 30.0594 175.0450 69 K 4.5989 9.0216 120.2881 54.5772 34.9252 177.5872 70 S 4.0946 9.1158 120.3867 61.4699 62.9179 175.7386 71 K 4.1629 7.9318 117.4351 57.2220 32.0295 177.0654 72 V 3.7988 7.6121 120.5368 62.4385 31.7766 174.4800 73 D 4.6896 8.7550 126.5986 53.8386 42.3270 176.9360 74 G 4.0313 9.2064 113.0250 45.8266 0.0000 172.1953 75 W 5.2398 7.8072 127.6588 56.3916 34.5100 173.3869 76 D 4.3880 6.9066 117.2084 54.5580 40.3212 176.1287 77 A 4.6840 7.0477 122.8210 51.1352 19.8354 176.1113 78 G 4.1364 7.9389 106.9395 46.0676 0.0000 172.1944 79 R 3.8553 7.4925 117.5059 54.7308 34.6949 174.1846 80 Y 4.8521 7.6041 112.9704 56.2878 38.2661 175.8678 81 P 4.6204 0.0000 0.0000 62.5215 29.9381 177.5232 82 E 4.0189 8.5048 126.3969 59.8531 29.8853 178.9512 83 K 3.9327 8.0796 119.8205 59.4760 32.5494 178.6633 84 A 4.2441 8.1023 120.3439 55.0625 18.3326 179.6647 85 S 4.1493 8.0835 113.7195 61.7930 62.9910 176.9346 86 K 4.0656 8.3588 121.0155 59.3794 31.8211 179.2999 87 A 4.0710 8.1242 120.8178 55.1767 18.2226 179.6712 88 F 3.9946 8.4765 116.0922 60.2296 38.8925 177.9417 89 L 4.1189 8.0112 119.1112 57.6505 41.3263 179.0788 90 D 4.3762 8.1427 118.9563 57.0260 40.7513 178.4588 91 L 3.8966 7.8136 120.6888 58.2981 42.1260 179.1139 92 L 4.1271 8.1938 119.0640 57.5780 41.5107 179.0922 93 E 3.9234 8.5226 119.7923 59.2728 29.5139 178.4355 94 N 4.2710 8.5259 117.0868 56.6437 38.9906 176.3625 95 A 3.9907 8.4633 122.4362 55.5189 18.5414 179.7979 96 V 3.6753 8.4016 116.8536 65.8236 31.5550 178.5293 97 G 3.6283 8.2430 105.5556 47.9150 0.0000 175.2702 98 N 4.3741 8.4789 119.7830 55.8338 38.6050 177.0918 99 A 4.2204 8.3715 122.3681 55.7069 18.3761 179.5328 100 D 4.6591 8.2962 118.4865 57.2486 40.7020 178.4635 101 H 4.1903 8.3122 117.6165 58.6527 29.9036 176.3461 102 Q 4.2564 7.6660 117.4747 55.7892 29.1007 176.4176 103 G 3.8496 8.0956 108.6077 44.9533 0.0000 173.8859 104 F 4.6308 8.0016 119.0745 57.0171 40.1397 174.7537 105 D 4.8186 8.5927 122.4129 52.2794 39.1153 176.6263 106 G 3.8504 8.8232 110.4738 48.6873 0.0000 173.0643 107 E 3.9298 8.3743 118.6561 58.6335 29.9305 179.6720 108 A 4.1289 7.8847 119.8625 54.6786 18.8485 177.7855 109 M 4.3724 7.9140 116.2149 55.8014 33.3633 176.0299 110 T 4.5475 8.6091 119.1331 63.1253 70.5143 174.7722 111 I 4.1017 8.9901 127.4644 60.9528 36.0985 176.5769 112 K 3.9930 8.8537 128.8867 59.0482 32.8757 176.4797 113 H 5.1931 8.0081 118.7019 54.5357 33.6711 172.6110 114 V 5.2927 8.4546 122.9138 61.7864 33.8153 172.6581 115 A 4.7912 8.5275 125.9977 50.3211 22.7187 174.2746 116 A 5.2723 8.5919 122.0405 50.8757 21.5795 176.2186 117 H 4.9408 9.4057 117.1240 53.8459 33.3127 172.7104 118 K 4.0003 7.9201 124.5067 55.9440 31.8487 176.4258 119 V 3.9008 8.8189 128.1215 62.6530 32.5642 175.6963 120 G 3.9773 6.6966 104.5562 47.0559 0.0000 170.5067 121 E 5.2045 8.1688 118.1585 54.5381 33.4914 175.3601 122 Q 4.2607 9.3659 126.6358 55.6028 30.1838 174.8713 123 Q 4.8646 8.7650 126.0888 55.7987 29.9284 175.4607 124 G 4.9590 10.0647 109.3089 43.7571 0.0000 171.1085 125 R 5.2492 8.5879 119.3863 54.1795 33.6408 174.1241 126 K 4.4039 9.0336 126.4451 53.6785 35.0568 173.5123 127 P 4.7000 0.0000 0.0000 62.8983 32.0130 175.6091 128 R 4.7697 8.6930 122.0933 53.7264 34.2803 174.8280 129 A 4.1075 8.4028 122.5307 53.2465 18.9125 177.2616 130 M 3.0307 9.2698 115.3697 56.4866 29.2914 178.0614 131 G 3.8606 8.4366 104.0607 46.0180 0.0000 173.5688 132 R 4.8236 7.5141 117.6063 54.0701 33.6013 174.1648 133 A 5.3443 8.4665 122.7938 50.1617 22.4818 175.0993 134 S 4.8801 8.8288 113.0547 55.9275 67.2203 173.2378 135 A 4.5306 8.6232 121.8899 52.4860 19.0113 178.1996 136 W 5.0262 9.0821 130.0051 56.3315 31.8630 173.2278 137 N 5.3553 8.0716 120.6101 51.3566 41.4158 174.0621 138 S 4.7654 8.8108 116.2989 56.1605 66.0320 172.6227 139 P 4.8034 0.0000 0.0000 62.5773 32.9072 175.0820 140 Q 5.0353 9.1772 121.8480 54.1439 31.7052 174.7210 141 V 4.7887 9.0993 124.2318 61.1514 34.6985 173.8869 142 D 5.4880 8.9614 127.4489 52.7115 43.9051 175.7817 143 V 5.0201 8.2355 120.4811 60.1950 35.0617 173.6102 144 E 5.0512 9.0031 122.4399 54.6545 32.6935 174.6486 145 L 5.2028 8.7701 122.8520 53.7523 46.2003 174.6636 146 I 4.9184 9.2825 126.9316 59.6301 40.2190 174.5566 147 L 5.0669 9.1978 127.7731 53.5010 43.9557 175.4478 148 E 4.8717 9.0045 122.4489 54.1076 33.2545 174.4415 149 E 4.1669 8.3808 125.0405 55.9209 30.9781 175.7596 150 P 4.3784 0.0000 0.0000 63.0348 31.3850 176.3475 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 G 8.34 3.81 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 0.00 0.00 0.00 2 I 7.92 3.95 1.65 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.54 0.71 0.00 0.00 3 S 8.64 4.63 0.00 3.80 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 4 Y 8.50 4.18 0.00 2.99 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 5 S 8.93 4.62 0.00 4.03 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 6 V 7.36 4.46 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 0.82 0.00 0.00 0.65 0.00 0.00 7 E 8.66 4.11 0.00 1.99 1.86 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 2.31 2.31 0.00 8 A 8.07 4.39 1.07 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 9 D 8.70 4.47 0.00 2.68 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 10 P 0.00 4.33 0.00 2.23 2.18 0.00 3.82 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 11 D 8.66 4.62 0.00 2.88 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 12 T 8.17 5.25 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 1.33 0.00 0.00 13 T 8.14 4.95 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 1.15 0.00 0.00 14 A 8.78 4.80 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 15 K 8.37 5.15 0.00 1.45 1.48 0.00 1.31 0.00 0.00 0.61 0.00 0.00 2.21 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.78 1.11 7.81 16 A 8.76 4.72 1.24 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 0.00 0.00 17 M 8.49 5.17 0.00 1.74 1.86 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.44 0.00 18 L 8.64 4.83 0.00 1.43 1.44 0.69 0.69 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 8.20 4.83 0.00 1.60 1.74 0.00 3.45 0.00 0.00 3.14 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.52 0.00 20 E 9.41 3.75 0.00 1.95 1.95 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 2.23 2.22 0.00 21 R 8.19 4.01 0.00 1.81 1.86 0.00 3.27 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.72 0.00 22 Q 8.94 5.27 0.00 1.94 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.76 0.00 0.00 0.00 0.00 0.00 2.31 2.19 0.00 23 M 7.96 4.84 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.59 0.00 24 S 8.64 4.08 0.00 3.64 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 F 8.96 4.40 0.00 3.04 2.99 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 26 K 7.87 3.51 0.00 1.57 1.44 0.00 1.56 0.00 0.00 1.52 0.00 0.00 2.76 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.86 1.33 7.81 27 H 8.49 4.05 0.00 3.26 3.33 0.00 5.64 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 28 S 7.80 4.19 0.00 4.09 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 K 7.69 3.79 0.00 1.51 1.62 0.00 1.40 0.00 0.00 1.38 0.00 0.00 2.13 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.85 0.70 7.81 30 A 7.32 3.81 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 I 7.70 3.47 1.12 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.79 -0.06 0.00 0.00 32 A 7.99 3.97 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.70 3.74 0.00 1.73 2.18 0.00 3.10 0.00 0.00 2.97 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 34 E 7.79 3.95 0.00 2.08 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 1.76 0.00 35 I 7.75 3.88 1.86 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.51 0.91 0.00 0.00 36 K 7.18 3.94 0.00 1.74 1.74 0.00 1.83 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.45 1.42 7.81 37 G 8.89 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.81 4.35 0.00 1.93 1.74 0.00 1.46 0.00 0.00 1.55 0.00 0.00 2.73 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.37 1.38 7.81 39 T 9.46 4.69 4.37 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 1.24 0.00 0.00 40 A 8.69 4.11 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 41 G 8.12 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 E 8.09 4.03 0.00 2.14 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 2.41 2.38 0.00 43 A 8.42 4.05 1.44 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 0.00 0.00 0.00 0.00 0.00 0.00 44 V 7.97 3.56 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 1.14 0.00 0.00 1.01 0.00 0.00 45 D 8.19 4.38 0.00 2.94 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 46 Y 8.43 4.09 0.00 3.11 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 L 8.54 3.82 0.00 1.86 1.73 1.06 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.48 3.96 0.00 2.13 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 2.34 2.67 0.00 49 A 7.94 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 50 V 7.30 4.09 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 1.38 0.00 0.00 0.35 0.00 0.00 51 I 7.56 3.74 1.99 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.82 0.90 0.00 0.00 52 E 8.19 4.10 0.00 2.13 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 0.00 2.29 2.32 0.00 53 G 7.81 3.41 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 0.00 54 D 8.02 4.59 0.00 2.64 2.71 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 55 Q 7.72 4.50 0.00 2.01 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 7.01 0.00 0.00 0.00 0.00 0.00 2.45 2.55 0.00 56 P 0.00 4.47 0.00 1.81 1.71 0.00 3.87 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 57 V 8.59 4.50 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 1.40 0.00 0.00 0.97 0.00 0.00 58 P 0.00 4.83 0.00 1.97 2.08 0.00 3.77 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.20 0.00 59 F 9.25 4.86 0.00 2.86 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 60 K 8.35 3.60 0.00 1.26 0.77 0.00 1.30 0.00 0.00 1.19 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.97 7.81 61 Q 7.95 4.29 0.00 1.78 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.40 0.00 0.00 0.00 0.00 0.00 1.74 2.16 0.00 62 H 7.61 4.68 0.00 2.97 3.16 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 63 N 7.90 5.19 0.00 3.04 3.52 0.00 0.00 5.86 7.35 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 64 S 8.11 4.38 0.00 4.04 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 65 G 8.96 3.96 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 0.00 0.00 0.00 66 V 7.53 3.73 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 0.68 0.00 0.00 1.10 0.00 0.00 67 G 8.44 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 0.00 0.00 0.00 68 H 8.62 4.90 0.00 2.96 3.15 0.00 5.66 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 69 K 9.02 4.60 0.00 1.53 1.63 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.76 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.39 1.26 7.81 70 S 9.12 4.09 0.00 3.98 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 71 K 7.93 4.16 0.00 1.81 1.95 0.00 1.80 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.46 7.81 72 V 7.61 3.80 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 0.91 0.00 0.00 0.94 0.00 0.00 73 D 8.76 4.69 0.00 2.82 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 74 G 9.21 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 0.00 0.00 0.00 75 W 7.81 5.24 0.00 3.26 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 76 D 6.91 4.39 0.00 2.03 2.31 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 77 A 7.05 4.68 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 78 G 7.94 4.14 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 0.00 0.00 0.00 79 R 7.49 3.86 0.00 0.67 1.31 0.00 2.85 0.00 0.00 3.07 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.09 0.00 80 Y 7.60 4.85 0.00 2.85 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 81 P 0.00 4.62 0.00 2.25 2.11 0.00 3.74 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 2.10 2.09 0.00 82 E 8.50 4.02 0.00 2.28 2.28 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 2.39 2.47 0.00 83 K 8.08 3.93 0.00 1.90 1.92 0.00 1.76 0.00 0.00 1.87 0.00 0.00 3.10 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.57 1.55 7.81 84 A 8.10 4.24 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 S 8.08 4.15 0.00 4.14 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 86 K 8.36 4.07 0.00 2.02 1.90 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.49 1.75 7.81 87 A 8.12 4.07 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 88 F 8.48 3.99 0.00 3.37 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 L 8.01 4.12 0.00 1.97 1.76 0.96 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 90 D 8.14 4.38 0.00 2.90 2.71 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 91 L 7.81 3.90 0.00 1.62 1.77 0.87 0.40 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 92 L 8.19 4.13 0.00 1.91 1.75 1.03 1.02 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 93 E 8.52 3.92 0.00 2.11 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 0.00 2.32 2.34 0.00 94 N 8.53 4.27 0.00 2.94 2.96 0.00 0.00 7.15 8.00 0.00 0.00 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 A 8.46 3.99 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 96 V 8.40 3.68 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 1.07 0.00 0.00 0.97 0.00 0.00 97 G 8.24 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 N 8.48 4.37 0.00 2.97 2.95 0.00 0.00 6.97 8.09 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 99 A 8.37 4.22 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 0.00 100 D 8.30 4.66 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 0.00 101 H 8.31 4.19 0.00 3.13 3.56 0.00 5.94 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 Q 7.67 4.26 0.00 2.35 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.24 0.00 0.00 0.00 0.00 0.00 2.38 2.59 0.00 103 G 8.10 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 0.00 0.00 0.00 104 F 8.00 4.63 0.00 3.31 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 0.00 105 D 8.59 4.82 0.00 2.73 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 G 8.82 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 0.00 0.00 0.00 107 E 8.37 3.93 0.00 2.06 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 0.00 2.43 2.36 0.00 108 A 7.88 4.13 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 0.00 109 M 7.91 4.37 0.00 1.90 2.09 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 2.50 2.42 0.00 110 T 8.61 4.55 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 1.29 0.00 0.00 111 I 8.99 4.10 1.87 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 1.14 0.72 0.94 0.00 0.00 112 K 8.85 3.99 0.00 1.76 1.98 0.00 1.72 0.00 0.00 1.62 0.00 0.00 2.84 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.46 1.38 7.81 113 H 8.01 5.19 0.00 3.21 3.10 0.00 5.78 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.45 5.29 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 0.85 0.00 0.00 1.16 0.00 0.00 115 A 8.53 4.79 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 0.00 116 A 8.59 5.27 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 0.00 117 H 9.41 4.94 0.00 3.00 3.11 0.00 5.81 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 K 7.92 4.00 0.00 0.79 1.06 0.00 1.42 0.00 0.00 1.39 0.00 0.00 2.58 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.11 1.05 7.81 119 V 8.82 3.90 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 0.73 0.00 0.00 0.92 0.00 0.00 120 G 6.70 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 0.00 121 E 8.17 5.20 0.00 1.77 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.22 0.00 122 Q 9.37 4.26 0.00 2.09 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 7.00 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 123 Q 8.77 4.86 0.00 1.99 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.59 0.00 0.00 0.00 0.00 0.00 2.36 2.52 0.00 124 G 10.06 4.96 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 0.00 0.00 0.00 125 R 8.59 5.25 0.00 1.79 1.77 0.00 3.29 0.00 0.00 3.18 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.68 0.00 126 K 9.03 4.40 0.00 1.25 1.52 0.00 1.02 0.00 0.00 1.12 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.58 1.09 7.81 127 P 0.00 4.70 0.00 1.89 1.92 0.00 3.49 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 1.94 2.06 0.00 128 R 8.69 4.77 0.00 1.75 1.82 0.00 3.34 0.00 0.00 3.20 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.71 0.00 129 A 8.40 4.11 1.26 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 0.00 0.00 130 M 9.27 3.03 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.46 0.00 131 G 8.44 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 R 7.51 4.82 0.00 1.92 1.75 0.00 3.05 0.00 0.00 3.18 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.55 0.00 133 A 8.47 5.34 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 0.00 134 S 8.83 4.88 0.00 3.94 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 0.00 135 A 8.62 4.53 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 0.00 136 W 9.08 5.03 0.00 3.42 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 0.00 137 N 8.07 5.36 0.00 2.58 2.82 0.00 0.00 7.04 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 S 8.81 4.77 0.00 3.68 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 0.00 139 P 0.00 4.80 0.00 2.27 1.94 0.00 3.51 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.07 0.00 140 Q 9.18 5.04 0.00 1.96 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.75 0.00 0.00 0.00 0.00 0.00 2.23 2.22 0.00 141 V 9.10 4.79 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 1.07 0.00 0.00 1.11 0.00 0.00 142 D 8.96 5.49 0.00 2.64 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 V 8.24 5.02 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 0.46 0.00 0.00 0.71 0.00 0.00 144 E 9.00 5.05 0.00 2.07 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 2.22 2.27 0.00 145 L 8.77 5.20 0.00 1.79 1.52 1.05 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 146 I 9.28 4.92 1.93 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.88 0.85 0.00 0.00 147 L 9.20 5.07 0.00 1.44 1.46 0.91 0.83 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 0.00 148 E 9.00 4.87 0.00 1.88 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 2.13 2.35 0.00 149 E 8.38 4.17 0.00 1.97 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 0.00 2.38 2.08 0.00 150 P 0.00 4.38 0.00 2.04 1.97 0.00 3.71 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 2.03 2.17 0.00