NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3519 8.1076 123.5848 51.7221 20.3692 179.1944 2 R 4.2588 8.7815 117.4968 58.0650 29.4299 174.0540 3 I 2.8061 9.0984 114.7660 61.0803 37.5224 172.1658 4 A 3.6924 8.1625 128.0527 52.2555 17.3380 179.5182 5 G 4.0130 7.7886 106.3304 43.2781 0.0000 173.4343 6 I 3.9210 8.0438 111.4576 62.4386 38.2875 176.3333 7 N 4.3111 8.1874 119.6034 54.1263 38.6762 174.0552 8 I 4.9585 7.9821 123.8607 58.3944 36.6985 173.2333 9 P 4.5658 0.0000 0.0000 61.5669 32.2280 174.9761 10 D 4.2292 8.5600 119.1250 55.6007 43.4848 176.0979 11 H 4.5549 8.9757 114.6406 56.2668 25.8597 174.5003 12 K 4.6943 7.3239 117.4705 53.7151 36.1323 176.3024 13 H 4.3252 8.5605 116.7191 55.6695 30.2169 175.9880 14 A 3.9740 8.7697 127.9471 55.7378 17.9663 180.0868 15 V 3.7321 7.2627 109.8567 64.2108 32.1899 178.7533 16 I 3.9661 7.7670 118.1296 63.8439 37.1398 178.1203 17 A 4.0640 8.4848 122.3286 55.0086 18.0714 179.5822 18 L 4.0531 7.9460 117.5889 57.8874 41.4490 179.0849 19 T 4.1988 7.4571 107.1948 63.1470 68.9348 176.0145 20 S 4.2717 7.7675 117.7205 59.2675 63.4068 174.1125 21 I 4.1741 7.2036 124.3329 61.0650 38.4208 176.3227 22 Y 4.5903 8.9676 124.1182 55.7271 35.8275 176.7617 23 G 5.3371 6.9105 119.4861 46.2669 0.0000 170.8031 24 V 4.5408 7.6112 112.1278 59.2030 35.6607 175.4931 25 G 4.4102 8.1003 111.9111 43.7160 0.0000 172.9974 26 K 3.9975 8.6278 117.0251 59.7646 31.5758 179.3344 27 T 3.9595 7.7922 115.7017 66.6687 68.4570 176.7491 28 R 3.9237 7.8255 119.4658 59.0009 30.2499 178.5686 29 S 4.2193 8.0659 112.3091 60.3011 62.1937 176.2511 30 K 4.0170 7.6186 119.7627 59.4380 32.0630 178.7469 31 A 4.1415 7.4094 118.2112 54.9342 18.4012 178.4466 32 I 3.9577 8.0046 119.5061 62.9227 36.6362 177.6943 33 L 3.9839 8.0708 120.4498 57.9466 41.6400 178.6904 34 A 4.5261 8.1041 118.4426 52.0049 18.5747 177.4326 35 A 4.6014 8.2407 120.2973 52.6485 20.5882 177.2975 36 A 4.6159 7.6011 117.6154 51.3988 19.7355 178.2352 37 G 4.0312 8.5272 105.6867 47.2595 0.0000 175.1212 38 I 3.8411 7.2584 120.3516 61.1398 38.2238 177.3619 39 A 4.3965 8.2877 130.9757 52.4875 18.6512 176.0583 40 E 4.3948 8.4484 108.3389 57.5948 31.3922 177.8185 41 D 5.3192 7.5670 120.4549 52.2519 40.2867 178.3472 42 V 4.0267 7.4863 114.3331 60.2534 30.0668 176.3062 43 K 3.9732 8.1269 123.5770 56.5114 33.1241 177.7625 44 I 4.0509 8.1517 119.3271 62.6679 37.2630 176.4638 45 S 4.5805 7.3426 114.9069 57.8205 62.1149 173.5768 46 E 5.1595 7.4921 128.0052 56.3041 31.3895 175.6004 47 L 4.4308 7.2746 119.1185 53.5787 41.5650 176.4824 48 S 4.4493 8.4128 122.7720 57.5544 63.9551 174.9826 49 E 3.8354 8.7927 121.6886 59.7685 29.2412 178.9216 50 G 3.9439 8.0328 105.3405 47.0005 0.0000 173.3049 51 Q 4.3378 7.9532 120.7164 56.7873 30.3880 177.0349 52 I 3.9457 8.0246 118.2544 63.1958 38.0637 176.8473 53 D 4.5542 8.0080 118.9684 55.3600 39.6504 178.4044 54 T 3.8768 7.7972 111.8508 64.8658 68.8810 176.3828 55 L 3.9558 7.9532 121.4716 57.5257 41.8759 179.0940 56 R 3.8459 7.8936 118.9135 59.7265 29.8175 177.5865 57 D 4.4027 7.6692 115.6981 56.8240 41.4731 177.5334 58 E 4.0707 7.9700 118.6461 58.3413 29.6794 178.1183 59 V 4.2223 7.8627 117.9987 62.8186 32.5415 177.3918 60 A 4.1974 7.6344 119.4653 53.7568 18.1564 179.2406 61 K 4.0348 7.5937 117.0356 58.5608 32.6960 177.2262 62 F 4.3863 7.5927 120.2730 57.5680 40.1141 175.2430 63 V 3.7610 7.2975 126.6386 62.5672 31.3048 174.8430 64 V 4.6952 7.7860 124.1964 61.3378 35.2118 174.9298 65 E 3.6734 8.3912 120.1135 57.9232 28.8243 176.2002 66 G 3.6946 8.0378 105.0841 49.3338 0.0000 175.0858 67 D 4.3588 8.0260 120.4448 56.9648 40.8217 178.3925 68 L 3.8624 7.8509 120.8486 58.2407 42.1513 179.1315 69 R 4.1341 8.0202 117.6979 58.5484 28.5346 178.7087 70 R 3.9941 7.4749 118.5449 58.7668 30.3724 177.6155 71 E 4.2445 7.8882 118.3355 58.5762 29.7162 178.5580 72 I 3.6614 8.1804 120.4833 64.4637 36.9988 178.3004 73 S 4.3117 7.8166 114.6311 60.3910 62.5427 176.1223 74 M 4.0801 7.3229 120.3896 58.2958 32.1257 178.0643 75 S 4.2477 7.7567 112.7655 61.3032 63.1665 176.4815 76 I 3.7344 7.5526 123.1042 64.2135 36.9650 177.9469 77 K 3.8298 7.5907 119.1451 59.7006 31.9606 178.5247 78 R 3.8789 8.4132 119.2145 59.5115 29.9071 178.4152 79 L 4.1230 7.9253 118.1838 57.2447 41.3311 178.7747 80 M 4.1641 7.8197 117.7907 57.2608 32.3779 177.6878 81 D 4.5381 7.9801 117.5837 56.3973 41.2552 178.3474 82 L 4.1701 7.5974 119.0333 56.5207 42.0582 178.1588 83 G 3.9010 8.2036 104.5671 46.7957 0.0000 174.1562 84 C 4.9445 7.6960 126.6714 57.9918 29.0643 173.9127 85 Y 4.4350 8.8162 115.7020 59.5055 39.2321 176.9735 86 R 4.1059 8.2273 118.5247 59.1079 30.0904 179.2186 87 G 4.0784 7.9053 106.3251 47.3816 0.0000 175.2642 88 L 3.8948 7.8052 120.3178 57.5231 42.0535 179.2297 89 R 3.9216 7.6437 117.5161 59.9684 29.8595 178.9543 90 H 4.1893 8.1366 113.9219 57.8711 28.5991 176.7544 91 R 4.5843 7.8940 119.3221 55.9655 30.3800 176.4651 92 R 4.4176 7.4830 112.4173 54.0616 33.0106 175.0925 93 G 3.9410 8.1615 105.7550 46.0983 0.0000 172.6203 94 L 4.7260 7.1536 115.7343 51.8923 46.4945 174.9167 95 P 4.2362 0.0000 0.0000 63.7701 31.4047 176.0777 96 V 4.1575 8.3635 119.1037 64.1627 32.9931 176.4988 97 R 4.3576 8.0300 117.4443 56.3898 29.9667 177.6734 98 G 4.0120 7.9549 106.7744 45.1506 0.0000 174.8349 99 Q 4.0733 7.9243 118.1472 55.7971 29.2942 177.1092 100 R 4.0774 8.4909 117.3329 56.9856 29.7484 176.5396 101 T 4.5213 8.1786 107.9003 61.2139 69.9608 174.9074 102 K 4.0743 8.1283 123.9954 59.5303 32.4602 175.7107 103 T 4.4215 7.5734 105.5873 61.9331 71.3607 173.6341 104 N 3.9520 8.2300 109.7334 54.9451 35.1776 173.6474 105 A 4.7044 7.3525 121.3686 51.5230 21.0996 178.9646 106 R 3.9424 7.8655 116.6275 59.7165 29.8710 177.7966 107 T 4.0250 7.1511 114.0545 65.7705 68.7525 174.9216 108 R 3.9766 7.9855 128.2995 58.3552 30.7446 177.2209 109 K 4.2580 7.7575 116.0146 55.4393 33.7414 176.6202 110 G 4.0650 8.1327 105.3705 44.2443 0.0000 171.5408 111 P 4.3659 0.0000 0.0000 62.5358 31.8348 176.5910 112 R 4.4278 8.0817 116.6099 54.6927 31.1055 176.1799 113 K 4.1840 8.3267 118.9447 55.2486 32.5222 175.6673 114 P 4.4203 0.0000 0.0000 62.8660 31.1886 176.2525 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 A 8.11 4.35 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 2 R 8.78 4.26 0.00 2.25 2.09 0.00 2.80 0.00 0.00 3.91 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 3 I 9.10 2.81 1.89 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 1.55 0.52 0.92 0.00 0.00 4 A 8.16 3.69 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 5 G 7.79 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 6 I 8.04 3.92 1.85 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.46 0.89 0.00 0.00 7 N 8.19 4.31 0.00 2.94 2.90 0.00 0.00 7.01 7.46 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 8 I 7.98 4.96 1.89 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 1.53 1.15 0.95 0.00 0.00 9 P 0.00 4.57 0.00 2.06 2.06 0.00 3.92 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 2.04 2.11 0.00 10 D 8.56 4.23 0.00 2.75 2.61 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 11 H 8.98 4.55 0.00 3.32 3.42 0.00 5.89 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 K 7.32 4.69 0.00 1.52 1.68 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.58 7.81 13 H 8.56 4.33 0.00 3.18 3.20 0.00 5.66 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 14 A 8.77 3.97 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 15 V 7.26 3.73 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 1.08 0.00 0.00 0.93 0.00 0.00 16 I 7.77 3.97 1.90 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 1.58 1.07 0.92 0.00 0.00 17 A 8.48 4.06 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 18 L 7.95 4.05 0.00 2.01 1.75 0.94 0.51 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 19 T 7.46 4.20 4.22 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 1.24 0.00 0.00 20 S 7.77 4.27 0.00 3.97 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 21 I 7.20 4.17 1.93 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 1.35 1.19 1.03 0.00 0.00 22 Y 8.97 4.59 0.00 3.02 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 23 G 6.91 5.34 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 0.00 24 V 7.61 4.54 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 0.78 0.00 0.00 1.05 0.00 0.00 25 G 8.10 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 0.00 0.00 0.00 0.00 26 K 8.63 4.00 0.00 1.76 1.86 0.00 1.68 0.00 0.00 1.81 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.47 7.81 27 T 7.79 3.96 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 1.16 0.00 0.00 28 R 7.83 3.92 0.00 1.83 1.93 0.00 2.96 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 29 S 8.07 4.22 0.00 3.91 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 30 K 7.62 4.02 0.00 2.02 1.80 0.00 1.73 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.49 1.60 7.81 31 A 7.41 4.14 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 32 I 8.00 3.96 2.03 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 1.76 0.91 0.92 0.00 0.00 33 L 8.07 3.98 0.00 1.63 1.85 0.97 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 34 A 8.10 4.53 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 35 A 8.24 4.60 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 36 A 7.60 4.62 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 37 G 8.53 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 38 I 7.26 3.84 1.96 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 1.23 0.85 0.91 0.00 0.00 39 A 8.29 4.40 1.21 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 40 E 8.45 4.39 0.00 2.12 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 2.26 2.24 0.00 41 D 7.57 5.32 0.00 2.66 2.55 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 42 V 7.49 4.03 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 0.74 0.00 0.00 0.95 0.00 0.00 43 K 8.13 3.97 0.00 1.80 1.73 0.00 1.57 0.00 0.00 1.78 0.00 0.00 2.83 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.66 1.50 7.81 44 I 8.15 4.05 2.05 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 1.29 0.72 0.95 0.00 0.00 45 S 7.34 4.58 0.00 3.83 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 46 E 7.49 5.16 0.00 1.93 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 2.04 2.14 0.00 47 L 7.27 4.43 0.00 1.88 1.59 0.92 0.98 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 48 S 8.41 4.45 0.00 3.93 3.78 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 0.00 0.00 0.00 49 E 8.79 3.84 0.00 2.04 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 2.38 2.39 0.00 50 G 8.03 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 0.00 0.00 0.00 51 Q 7.95 4.34 0.00 2.11 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.68 0.00 0.00 0.00 0.00 0.00 2.28 2.27 0.00 52 I 8.02 3.95 1.87 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 1.59 1.22 1.01 0.00 0.00 53 D 8.01 4.55 0.00 2.95 2.91 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 54 T 7.80 3.88 4.25 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 1.24 0.00 0.00 55 L 7.95 3.96 0.00 1.89 1.76 0.93 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 56 R 7.89 3.85 0.00 2.02 2.13 0.00 3.09 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.78 0.00 57 D 7.67 4.40 0.00 2.66 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 E 7.97 4.07 0.00 2.25 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 0.00 2.33 2.38 0.00 59 V 7.86 4.22 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 0.94 0.00 0.00 0.99 0.00 0.00 60 A 7.63 4.20 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 61 K 7.59 4.03 0.00 1.77 1.96 0.00 1.85 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.68 7.81 62 F 7.59 4.39 0.00 2.89 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 63 V 7.30 3.76 1.73 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 0.73 0.00 0.00 0.81 0.00 0.00 64 V 7.79 4.70 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 0.97 0.00 0.00 0.99 0.00 0.00 65 E 8.39 3.67 0.00 2.15 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.38 0.00 66 G 8.04 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 0.00 0.00 0.00 67 D 8.03 4.36 0.00 2.88 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 68 L 7.85 3.86 0.00 1.91 1.91 0.86 0.91 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 69 R 8.02 4.13 0.00 1.99 1.99 0.00 3.39 0.00 0.00 3.15 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.85 0.00 70 R 7.47 3.99 0.00 1.86 2.05 0.00 3.47 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.74 0.00 71 E 7.89 4.24 0.00 2.17 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 2.25 2.43 0.00 72 I 8.18 3.66 1.88 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 1.52 0.97 0.92 0.00 0.00 73 S 7.82 4.31 0.00 3.80 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 74 M 7.32 4.08 0.00 2.36 2.12 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.56 0.00 75 S 7.76 4.25 0.00 4.07 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 76 I 7.55 3.73 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 1.26 0.64 0.85 0.00 0.00 77 K 7.59 3.83 0.00 1.85 1.94 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.45 7.81 78 R 8.41 3.88 0.00 1.94 2.07 0.00 3.14 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 79 L 7.93 4.12 0.00 1.88 1.69 0.88 0.96 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 80 M 7.82 4.16 0.00 1.98 2.23 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.56 0.00 81 D 7.98 4.54 0.00 2.64 2.72 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 82 L 7.60 4.17 0.00 1.71 1.73 0.95 1.06 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 83 G 8.20 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 0.00 0.00 0.00 84 C 7.70 4.94 0.00 3.16 2.38 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 85 Y 8.82 4.43 0.00 3.07 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 86 R 8.23 4.11 0.00 1.95 2.06 0.00 3.25 0.00 0.00 3.40 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.80 0.00 87 G 7.91 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 88 L 7.81 3.89 0.00 1.51 1.63 0.90 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 89 R 7.64 3.92 0.00 1.84 1.87 0.00 3.48 0.00 0.00 2.95 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.59 0.00 90 H 8.14 4.19 0.00 3.37 3.35 0.00 5.64 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 R 7.89 4.58 0.00 1.84 1.96 0.00 3.19 0.00 0.00 3.21 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.64 0.00 92 R 7.48 4.42 0.00 1.91 1.82 0.00 3.31 0.00 0.00 3.20 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.66 0.00 93 G 8.16 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 0.00 0.00 0.00 94 L 7.15 4.73 0.00 1.52 1.47 nan 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 95 P 0.00 4.24 0.00 2.26 2.09 0.00 3.71 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 96 V 8.36 4.16 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 1.09 0.00 0.00 0.77 0.00 0.00 97 R 8.03 4.36 0.00 1.99 1.95 0.00 3.27 0.00 0.00 3.25 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.59 0.00 98 G 7.95 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 Q 7.92 4.07 0.00 2.04 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.89 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 100 R 8.49 4.08 0.00 1.92 1.96 0.00 2.98 0.00 0.00 3.36 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 101 T 8.18 4.52 4.25 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 1.29 0.00 0.00 102 K 8.13 4.07 0.00 1.74 1.88 0.00 1.77 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.42 1.43 7.81 103 T 7.57 4.42 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 0.00 104 N 8.23 3.95 0.00 2.81 3.01 0.00 0.00 6.52 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 0.00 105 A 7.35 4.70 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 0.00 106 R 7.87 3.94 0.00 1.86 1.98 0.00 3.30 0.00 0.00 3.40 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.66 0.00 107 T 7.15 4.02 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 0.00 108 R 7.99 3.98 0.00 1.73 1.95 0.00 3.21 0.00 0.00 3.11 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 109 K 7.76 4.26 0.00 1.80 1.83 0.00 1.92 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.33 7.81 110 G 8.13 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 111 P 0.00 4.37 0.00 2.05 2.01 0.00 3.67 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 112 R 8.08 4.43 0.00 1.91 1.92 0.00 3.03 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.64 0.00 113 K 8.33 4.18 0.00 1.77 1.80 0.00 1.77 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.40 7.81 114 P 0.00 4.42 0.00 2.04 1.97 0.00 3.71 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00