NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 S 4.3740 8.3344 115.2920 57.6567 63.5893 172.5642 4 L 4.0665 8.2122 125.3909 53.0583 42.6069 174.1667 5 P 4.3388 0.0000 0.0000 63.2934 32.9353 177.8306 6 K 4.0410 8.7281 126.8502 59.6771 31.5009 177.6813 7 R 4.1195 7.9840 117.8676 59.8732 30.0558 178.5484 8 I 3.8467 7.6894 119.8023 64.3968 37.0888 178.5167 9 I 3.8308 7.9020 122.7299 64.8272 37.1128 179.1370 10 K 4.0355 8.3319 124.6708 59.8737 31.7300 180.8651 11 E 4.2272 8.4265 120.3778 59.5613 29.3851 179.6984 12 T 4.0159 8.1737 115.7633 66.6128 68.4334 176.2852 13 E 3.9656 8.2898 121.2226 59.3955 29.5887 179.1111 14 K 4.0647 8.0189 117.9512 59.2958 31.8157 179.4444 15 L 4.0181 7.8948 119.0828 57.7455 41.4306 179.5223 16 V 3.9505 7.7806 110.4437 63.1126 31.6725 177.9027 17 S 4.6080 7.6990 113.9292 58.9200 64.9852 174.0720 18 D 4.9314 7.9002 119.9848 51.3132 40.5471 173.2880 19 P 4.5710 0.0000 0.0000 61.4856 32.7124 177.4508 20 V 3.6999 8.2110 120.5098 62.0007 32.1112 173.6694 21 P 4.4431 0.0000 0.0000 64.3452 31.6563 176.7672 22 G 4.0095 9.1383 110.0743 45.5261 0.0000 172.2933 23 I 5.0472 7.8096 119.7625 59.6726 40.4035 174.9846 24 T 4.7863 9.0481 123.3618 61.7621 71.5149 173.5016 25 A 5.1440 8.5256 125.8216 50.5597 22.1152 175.1612 26 E 4.7814 9.5588 122.8626 54.0115 32.7642 174.2805 27 P 4.1066 0.0000 0.0000 62.2328 32.4132 176.0313 28 H 4.4422 8.7675 118.8303 55.6059 29.2525 175.0503 29 D 4.2509 8.4596 120.8549 55.4931 41.5560 176.8231 30 D 4.7291 9.1801 125.0115 54.2777 40.9002 173.3571 31 N 4.8525 7.6073 114.9185 51.7206 39.5626 174.3490 32 L 3.9274 8.3130 124.7510 56.7390 42.1573 178.7711 33 R 4.1038 7.9680 117.1678 57.8249 31.4198 175.4508 34 Y 5.1629 7.8383 117.9502 56.0581 40.5947 174.7978 35 F 5.2185 9.6264 122.9471 55.6552 42.9113 173.9190 36 Q 4.8057 9.2976 124.6525 54.7980 30.7070 174.2987 37 V 5.0664 8.6836 126.6159 61.2058 34.7015 174.1171 38 T 5.1882 8.8178 117.2976 59.9432 71.9189 172.8174 39 I 5.0225 8.7416 124.9620 59.3491 40.5424 174.7957 40 E 4.4579 9.1922 127.8217 55.9701 30.0233 177.3700 41 G 4.6865 9.3991 112.2326 45.3578 0.0000 171.8635 42 P 4.5958 0.0000 0.0000 62.0326 32.1522 175.9599 43 E 4.1930 8.6183 121.6580 58.1255 29.8370 177.5353 44 Q 3.7377 9.6993 120.7044 56.2170 27.5688 173.5178 45 S 4.7855 7.5940 113.0629 55.7949 65.2379 173.3190 46 P 4.2805 0.0000 0.0000 64.7380 31.2798 177.5580 47 Y 5.0623 7.6378 114.7371 56.8433 38.5885 175.4950 48 E 4.6542 7.8924 119.0898 57.7441 30.1849 177.2755 49 D 4.9361 9.0893 120.0297 54.1957 39.8707 175.0562 50 G 4.1098 7.7952 104.9839 45.0347 0.0000 172.8641 51 I 5.0752 7.8482 120.8746 59.2218 40.5355 174.5008 52 F 5.1280 9.3678 125.2658 55.7206 42.0940 174.1782 53 E 5.1009 9.4692 122.6191 54.8433 31.7420 175.1558 54 L 5.0973 9.0563 123.2675 52.8306 46.5911 174.7746 55 E 5.1795 9.1337 122.1868 54.4324 32.3991 174.4092 56 L 5.2820 8.8376 127.9343 53.4380 45.6039 174.2763 57 Y 5.0441 9.0830 127.0118 55.7076 42.2372 173.9798 58 L 4.2751 7.5968 126.5695 52.0310 42.6600 174.9787 59 P 3.9170 0.0000 0.0000 61.9794 31.9991 177.4275 60 D 4.2958 8.6049 119.8338 57.5785 40.9969 177.5377 61 D 4.6772 7.9483 116.5448 54.1837 41.2600 175.5338 62 Y 4.5972 8.0314 121.1871 56.7727 39.2360 173.9052 63 P 3.6324 0.0000 0.0000 62.8044 31.7216 177.5801 64 M 4.1292 7.9939 120.0252 57.3844 32.0003 175.9934 65 E 4.5666 7.4538 117.1084 53.6971 31.5053 175.1521 66 A 2.5800 7.9337 128.3368 50.7422 19.0648 175.3950 67 P 4.2195 0.0000 0.0000 62.4418 32.5816 175.8259 68 K 4.5375 8.8821 121.5507 54.8905 34.0536 175.8622 69 V 5.0985 8.2633 124.2277 61.2292 34.7836 174.5346 70 R 4.9867 8.6639 121.9204 54.8879 33.0688 174.2095 71 F 4.3823 9.3022 120.6609 57.7987 39.1702 175.3301 72 L 4.6094 9.1467 122.1604 56.2968 43.5131 177.8044 73 T 4.2059 8.0626 115.3201 62.8682 69.1230 174.4986 74 K 4.1966 8.4992 125.9014 56.5915 32.7056 176.2244 75 I 5.0022 8.2084 121.3234 59.9562 40.9561 173.8146 76 Y 4.6170 9.0198 127.4368 56.6175 38.2941 174.1332 77 H 4.5359 7.8993 125.9375 53.8268 33.1324 172.5786 78 P 4.2651 0.0000 0.0000 64.6737 31.6794 177.1300 79 N 4.7452 8.0957 114.9695 52.6623 39.3904 173.4741 80 I 4.6615 7.2003 118.2177 59.3136 39.7953 175.2538 81 D 4.7288 8.3542 126.2076 51.8756 40.8990 177.2941 82 R 4.1451 8.4978 114.6507 58.7040 29.3210 177.1897 83 L 4.3216 8.1611 116.6221 54.2612 42.2080 176.9329 84 G 3.9780 8.6375 108.0503 46.0406 0.0000 173.6894 85 R 4.4213 8.4799 119.1749 55.6183 30.8183 175.3723 86 I 4.5624 8.1586 122.2448 60.0785 39.0821 175.6212 87 C 4.5271 8.3846 125.0476 58.6553 28.0034 172.6201 88 L 4.5666 7.9041 122.6832 52.3081 45.4815 176.8266 89 D 4.4376 9.1053 124.1358 57.1825 40.6325 179.0829 90 V 3.7514 7.8699 118.4206 64.1156 31.3940 177.2219 91 L 4.5146 7.7362 117.5503 52.9284 42.2902 176.4215 92 K 4.5933 8.7169 116.8233 56.5879 32.1254 178.6321 93 T 3.9223 9.4568 117.0078 65.4093 69.0155 175.1331 94 N 4.6435 8.0619 116.2676 52.8865 39.1317 175.0501 95 W 4.1939 7.7770 129.2688 57.3806 31.5878 175.1357 96 S 4.3855 6.2196 116.9402 56.0684 65.1267 173.2517 97 P 4.2600 0.0000 0.0000 64.5237 31.1121 177.4463 98 A 3.9630 7.1003 120.6283 53.5829 18.5708 177.6234 99 L 4.2341 6.7951 115.8256 53.6875 43.1032 175.2594 100 Q 4.9932 7.9886 116.2404 53.5070 32.9860 176.9699 101 I 3.7188 9.5955 120.3354 64.8309 36.9873 178.7752 102 R 3.9097 8.0804 118.8818 59.8639 29.8421 178.4995 103 T 3.9232 7.7687 115.1271 66.5701 68.4530 176.8784 104 V 3.7138 7.8369 119.7827 65.8562 31.6218 177.9933 105 L 3.9608 8.0013 118.9338 57.6229 41.4504 179.2247 106 L 3.9667 8.0248 120.3488 58.2211 42.0488 179.1905 107 S 4.1500 8.0663 115.0607 61.5687 62.8728 176.8012 108 I 3.7185 7.7428 122.4417 64.4432 36.6358 178.1562 109 Q 3.9809 8.2819 120.2552 59.2743 28.8284 178.3712 110 A 4.0098 8.2154 121.7861 54.9652 18.1633 179.3241 111 L 3.9001 7.7022 118.1484 58.2429 42.1799 178.9044 112 L 3.8963 7.5627 117.5327 57.6865 41.6179 179.0845 113 A 4.3887 7.6963 119.2953 53.5245 19.6785 177.8271 114 S 4.6256 7.5952 112.5867 55.4999 63.1884 171.5350 115 P 3.9910 0.0000 0.0000 62.6149 31.9508 176.5125 116 N 4.7725 8.0333 120.6521 50.7027 38.8108 172.6031 117 P 4.2889 0.0000 0.0000 63.9961 31.9131 177.4355 118 N 4.7357 7.8294 115.5761 53.0111 38.9899 174.3446 119 D 4.4716 7.6799 119.9975 53.3784 41.7468 175.1487 120 P 4.3814 0.0000 0.0000 64.2173 30.8806 177.0795 121 L 4.7064 8.1291 115.4061 53.6054 43.0177 180.6584 122 A 4.1955 7.7747 122.1029 53.0902 19.0021 178.1584 123 N 4.7101 8.4615 119.1423 51.8320 38.9529 175.4323 124 D 4.5211 8.5268 116.7155 55.7627 39.5796 177.4051 125 V 4.0417 8.5982 113.4926 62.6265 32.4747 177.8813 126 A 3.9560 8.0898 122.9347 55.4476 18.0712 179.2616 127 E 3.9607 8.2942 116.3016 59.9768 29.5177 179.3591 128 D 4.3851 8.1530 118.1951 57.1733 40.7250 178.7108 129 W 3.8823 7.9729 118.2821 59.2161 29.0336 178.5003 130 I 4.0280 7.5059 119.0876 64.2839 36.9949 178.1678 131 K 4.2486 8.0897 117.1727 57.7090 33.3354 176.8593 132 N 4.9995 8.3171 117.9515 50.8079 39.2180 174.7374 133 E 3.7962 8.1630 120.2571 59.9296 29.8919 179.0431 134 Q 3.9331 7.9137 118.2768 58.7785 28.9123 178.8204 135 G 3.4692 7.8737 105.9960 47.3533 0.0000 175.5700 136 A 3.7673 7.9835 123.4065 54.9623 18.3254 179.9656 137 K 3.4324 7.4957 116.7157 59.1877 31.9476 179.5541 138 A 3.8957 7.6422 121.0227 54.9007 18.1902 179.6312 139 K 3.6192 7.9471 118.0207 59.2980 32.1104 178.9630 140 A 4.1519 7.9895 121.2845 55.2015 18.3004 179.6365 141 R 4.3154 7.9438 118.6316 58.9250 30.1340 178.3803 142 E 3.9881 8.3257 119.3361 59.2410 29.7240 178.9385 143 W 4.5858 8.7736 119.1915 59.9726 28.7849 178.7102 144 T 4.2300 8.3288 116.1447 66.5802 67.7165 176.4825 145 K 3.9689 7.9615 120.3949 59.5479 32.3210 178.5463 146 L 3.9154 7.7794 117.9826 57.1729 41.6702 178.0403 147 Y 4.5624 8.2147 114.3881 57.6809 39.5993 176.3495 148 A 4.0367 7.2103 121.9578 52.5135 19.4173 177.4572 149 K 4.1183 8.2062 119.2488 56.6726 32.8205 176.5450 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 S 8.33 4.37 0.00 3.85 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 4 L 8.21 4.07 0.00 1.72 1.57 0.94 0.65 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 5 P 0.00 4.34 0.00 2.27 2.00 0.00 3.69 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.11 0.00 6 K 8.73 4.04 0.00 1.76 1.82 0.00 1.79 0.00 0.00 1.74 0.00 0.00 2.84 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.44 1.07 7.81 7 R 7.98 4.12 0.00 1.89 2.01 0.00 3.14 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.79 0.00 8 I 7.69 3.85 2.07 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.65 0.97 0.00 0.00 9 I 7.90 3.83 2.03 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 1.52 0.87 0.94 0.00 0.00 10 K 8.33 4.04 0.00 1.75 1.81 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.35 7.81 11 E 8.43 4.23 0.00 2.19 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 2.39 2.44 0.00 12 T 8.17 4.02 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 13 E 8.29 3.97 0.00 2.19 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 0.00 2.33 2.52 0.00 14 K 8.02 4.06 0.00 2.05 1.86 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.67 7.81 15 L 7.89 4.02 0.00 1.94 1.74 0.75 0.66 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 16 V 7.78 3.95 2.12 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 0.92 0.00 0.00 1.05 0.00 0.00 17 S 7.70 4.61 0.00 3.90 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 0.00 18 D 7.90 4.93 0.00 2.59 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.57 0.00 2.24 2.14 0.00 3.50 0.00 0.00 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.93 0.00 20 V 8.21 3.70 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 1.00 0.00 0.00 0.93 0.00 0.00 21 P 0.00 4.44 0.00 2.10 2.02 0.00 3.81 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 2.05 2.11 0.00 22 G 9.14 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 23 I 7.81 5.05 1.88 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 1.24 0.74 0.95 0.00 0.00 24 T 9.05 4.79 4.27 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 0.00 0.00 0.00 1.25 0.00 0.00 25 A 8.53 5.14 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 26 E 9.56 4.78 0.00 1.90 1.84 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 2.24 2.27 0.00 27 P 0.00 4.11 0.00 1.57 0.64 0.00 3.71 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.80 0.00 28 H 8.77 4.44 0.00 3.15 3.22 0.00 5.68 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 D 8.46 4.25 0.00 2.64 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 D 9.18 4.73 0.00 2.84 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 N 7.61 4.85 0.00 2.84 2.75 0.00 0.00 7.04 6.54 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 32 L 8.31 3.93 0.00 1.64 1.68 0.94 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 33 R 7.97 4.10 0.00 1.74 1.79 0.00 3.08 0.00 0.00 3.34 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 34 Y 7.84 5.16 0.00 2.66 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 F 9.63 5.22 0.00 2.87 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 36 Q 9.30 4.81 0.00 2.17 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.75 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 37 V 8.68 5.07 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.93 0.00 0.00 38 T 8.82 5.19 4.27 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 0.00 0.00 0.00 1.23 0.00 0.00 39 I 8.74 5.02 1.96 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.77 0.97 0.00 0.00 40 E 9.19 4.46 0.00 2.03 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 2.41 2.33 0.00 41 G 9.40 4.69 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 42 P 0.00 4.60 0.00 2.32 2.06 0.00 3.82 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.18 0.00 43 E 8.62 4.19 0.00 2.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 44 Q 9.70 3.74 0.00 2.22 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.72 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 45 S 7.59 4.79 0.00 4.19 4.13 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 0.00 0.00 0.00 0.00 46 P 0.00 4.28 0.00 1.52 2.10 0.00 3.29 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.00 0.00 47 Y 7.64 5.06 0.00 3.25 3.26 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 48 E 7.89 4.65 0.00 2.28 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 2.44 2.35 0.00 49 D 9.09 4.94 0.00 2.94 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 50 G 7.80 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 I 7.85 5.08 1.81 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.14 0.93 0.00 0.00 52 F 9.37 5.13 0.00 3.14 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 E 9.47 5.10 0.00 1.89 1.85 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 2.25 2.27 0.00 54 L 9.06 5.10 0.00 1.34 1.35 0.48 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 55 E 9.13 5.18 0.00 2.04 1.81 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 2.34 2.38 0.00 56 L 8.84 5.28 0.00 1.68 1.44 0.67 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 57 Y 9.08 5.04 0.00 2.77 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 58 L 7.60 4.28 0.00 1.12 1.02 0.64 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 59 P 0.00 3.92 0.00 2.06 1.92 0.00 3.32 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.94 0.00 60 D 8.60 4.30 0.00 2.68 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 61 D 7.95 4.68 0.00 2.74 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 62 Y 8.03 4.60 0.00 2.77 2.84 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 63 P 0.00 3.63 0.00 1.98 1.25 0.00 3.61 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 1.86 1.76 0.00 64 M 7.99 4.13 0.00 2.08 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 2.61 2.47 0.00 65 E 7.45 4.57 0.00 2.09 1.76 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 2.17 2.17 0.00 66 A 7.93 2.58 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 67 P 0.00 4.22 0.00 1.62 1.54 0.00 2.85 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.59 0.00 68 K 8.88 4.54 0.00 1.72 1.75 0.00 1.62 0.00 0.00 1.51 0.00 0.00 2.73 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.64 7.81 69 V 8.26 5.10 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 0.81 0.00 0.00 0.83 0.00 0.00 70 R 8.66 4.99 0.00 2.07 2.00 0.00 2.86 0.00 0.00 3.20 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.66 0.00 71 F 9.30 4.38 0.00 3.05 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 L 9.15 4.61 0.00 1.62 1.74 0.94 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 73 T 8.06 4.21 4.70 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 1.42 0.00 0.00 74 K 8.50 4.20 0.00 1.11 1.15 0.00 1.46 0.00 0.00 1.53 0.00 0.00 2.75 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.19 0.68 7.81 75 I 8.21 5.00 2.03 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.94 0.61 0.00 0.00 76 Y 9.02 4.62 0.00 2.22 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 77 H 7.90 4.54 0.00 2.95 2.74 0.00 5.72 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 78 P 0.00 4.27 0.00 1.89 1.66 0.00 2.31 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.91 0.00 79 N 8.10 4.75 0.00 2.64 2.72 0.00 0.00 6.91 6.99 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 80 I 7.20 4.66 1.42 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.16 0.40 0.00 0.00 81 D 8.35 4.73 0.00 2.94 2.80 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 0.00 0.00 0.00 82 R 8.50 4.15 0.00 2.00 2.21 0.00 3.05 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 83 L 8.16 4.32 0.00 1.81 1.75 0.93 0.92 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 84 G 8.64 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 85 R 8.48 4.42 0.00 2.23 1.85 0.00 3.11 0.00 0.00 3.18 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.61 0.00 86 I 8.16 4.56 1.91 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.70 0.92 0.00 0.00 87 C 8.38 4.53 0.00 2.83 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 88 L 7.90 4.57 0.00 1.56 1.53 0.94 1.07 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 89 D 9.11 4.44 0.00 2.70 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 V 7.87 3.75 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 0.88 0.00 0.00 1.05 0.00 0.00 91 L 7.74 4.51 0.00 1.84 1.73 0.93 0.78 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 92 K 8.72 4.59 0.00 1.75 1.23 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.36 1.49 7.81 93 T 9.46 3.92 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 94 N 8.06 4.64 0.00 2.90 2.89 0.00 0.00 6.84 7.68 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 95 W 7.78 4.19 0.00 3.63 3.17 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 0.00 0.00 0.00 96 S 6.22 4.39 0.00 3.77 3.64 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 97 P 0.00 4.26 0.00 1.95 2.05 0.00 3.52 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 1.97 2.22 0.00 98 A 7.10 3.96 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 99 L 6.80 4.23 0.00 0.27 1.31 0.63 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 100 Q 7.99 4.99 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.79 0.00 0.00 0.00 0.00 0.00 2.31 2.30 0.00 101 I 9.60 3.72 1.86 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.77 0.63 0.00 0.00 102 R 8.08 3.91 0.00 1.87 1.95 0.00 3.19 0.00 0.00 3.34 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 103 T 7.77 3.92 4.48 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 1.23 0.00 0.00 104 V 7.84 3.71 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 1.15 0.00 0.00 105 L 8.00 3.96 0.00 1.87 1.67 0.84 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.02 3.97 0.00 1.98 1.67 0.98 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 107 S 8.07 4.15 0.00 4.11 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 0.00 108 I 7.74 3.72 2.01 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.24 1.00 0.00 0.00 109 Q 8.28 3.98 0.00 2.21 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.42 0.00 110 A 8.22 4.01 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 0.00 111 L 7.70 3.90 0.00 1.73 1.84 0.87 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 112 L 7.56 3.90 0.00 1.82 1.56 0.76 -0.20 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 0.00 113 A 7.70 4.39 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 0.00 114 S 7.60 4.63 0.00 3.96 3.76 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 0.00 115 P 0.00 3.99 0.00 1.55 0.85 0.00 3.61 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.88 0.00 116 N 8.03 4.77 0.00 2.63 2.56 0.00 0.00 6.96 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 0.00 117 P 0.00 4.29 0.00 2.23 2.09 0.00 3.78 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.06 0.00 118 N 7.83 4.74 0.00 2.71 2.86 0.00 0.00 6.91 8.06 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 0.00 119 D 7.68 4.47 0.00 2.73 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.38 0.00 2.20 2.12 0.00 3.74 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 121 L 8.13 4.71 0.00 1.63 1.51 0.92 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 122 A 7.77 4.20 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 0.00 123 N 8.46 4.71 0.00 2.95 2.96 0.00 0.00 6.72 7.36 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 0.00 124 D 8.53 4.52 0.00 2.83 2.86 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 V 8.60 4.04 1.59 0.00 0.00 0.00 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 0.66 0.00 0.00 126 A 8.09 3.96 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 0.00 127 E 8.29 3.96 0.00 2.05 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 2.42 2.43 0.00 128 D 8.15 4.39 0.00 2.93 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 0.00 129 W 7.97 3.88 0.00 3.38 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 0.00 130 I 7.51 4.03 2.02 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 1.84 0.78 0.94 0.00 0.00 131 K 8.09 4.25 0.00 1.73 1.86 0.00 1.66 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.47 1.45 7.81 132 N 8.32 5.00 0.00 2.65 2.70 0.00 0.00 6.75 7.27 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 0.00 133 E 8.16 3.80 0.00 2.15 2.34 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 2.32 2.35 0.00 134 Q 7.91 3.93 0.00 2.04 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.95 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 135 G 7.87 3.47 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 0.00 136 A 7.98 3.77 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 K 7.50 3.43 0.00 1.62 1.66 0.00 1.53 0.00 0.00 1.55 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.20 0.97 7.81 138 A 7.64 3.90 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 0.00 139 K 7.95 3.62 0.00 1.49 1.42 0.00 0.68 0.00 0.00 1.14 0.00 0.00 2.79 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.30 0.21 7.81 140 A 7.99 4.15 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 0.00 141 R 7.94 4.32 0.00 1.91 2.07 0.00 3.21 0.00 0.00 3.22 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.56 0.00 142 E 8.33 3.99 0.00 2.16 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 2.49 2.41 0.00 143 W 8.77 4.59 0.00 3.63 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 0.00 144 T 8.33 4.23 4.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 145 K 7.96 3.97 0.00 1.81 2.11 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.48 7.81 146 L 7.78 3.92 0.00 0.88 0.78 0.76 0.74 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 0.00 147 Y 8.21 4.56 0.00 3.06 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 0.00 148 A 7.21 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 K 8.21 4.12 0.00 1.75 2.13 0.00 1.62 0.00 0.00 1.68 0.00 0.00 3.09 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.28 1.30 7.81