NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2723 7.8827 121.4485 61.2041 38.7782 173.7758 17 V 4.1836 8.6936 125.8117 61.8381 32.5700 174.5522 18 G 3.7568 8.4471 114.0674 46.4231 0.0000 173.6240 19 G 4.1548 7.7431 110.2390 44.5817 0.0000 172.6279 20 Y 4.9617 7.9197 117.4937 55.3181 42.2764 174.9060 21 T 4.2443 8.5708 117.1959 64.0005 68.3906 175.2945 22 C 4.2667 8.6418 125.4449 60.3685 35.7609 174.9888 23 G 4.1120 8.6153 106.0277 44.0393 0.0000 172.7934 24 A 4.1492 8.6089 125.0121 53.7157 18.5281 176.9997 25 N 4.2743 8.8987 119.2399 54.5527 36.1701 175.4602 26 T 4.1874 7.5919 108.4709 62.8850 69.9257 175.1698 27 V 4.1408 7.0771 122.1947 59.6884 31.3460 173.5687 28 P 4.5694 0.0000 0.0000 64.2031 31.7855 178.3192 29 Y 5.0155 7.0273 115.1684 56.7559 38.8198 174.6037 30 Q 4.5933 7.2030 123.3204 56.2487 29.5061 175.5079 31 V 4.8458 8.9723 119.1231 59.6223 36.0049 174.2236 32 S 4.7288 8.6228 117.0122 56.5301 64.9829 172.7411 33 L 4.3870 8.5369 128.0172 53.5887 42.7968 175.0688 34 N 5.8075 8.9480 123.3756 50.0981 41.9149 175.0267 *37 S 4.3594 8.3840 119.5724 58.3244 64.1702 174.5690 38 G 4.0041 9.8597 108.9181 46.0459 0.0000 172.8461 39 Y 4.4900 6.7296 115.1317 56.3399 39.9299 172.4520 40 H 4.6070 8.8990 121.7004 55.8805 30.3283 174.5884 41 F 4.9906 7.8429 121.2606 57.5320 40.1501 174.6176 42 C 4.8106 6.7415 114.5520 55.7099 44.9105 173.9768 43 G 4.1018 8.7475 109.5107 45.8838 0.0000 172.2948 44 G 4.4874 7.6867 104.3027 46.4533 0.0000 172.7841 45 S 5.4148 8.6887 115.3020 56.4962 67.0195 173.5526 46 L 4.8555 9.3432 127.9198 54.7614 42.3540 177.0984 47 I 4.3718 8.5707 119.8232 61.3713 39.0816 174.5169 48 N 4.7982 7.6610 117.2968 51.8619 39.6805 175.0293 49 S 4.3547 8.7149 112.0575 60.7771 63.0865 175.0495 50 Q 4.6341 8.9873 118.2678 55.0609 30.9850 174.8952 51 W 5.5599 8.4455 118.0906 54.8479 33.5415 174.4231 52 V 5.0685 9.1482 123.0871 61.1288 34.7598 174.1317 53 V 4.9296 8.9698 126.1293 61.6127 33.7636 174.6188 54 S 5.1534 9.0672 121.1811 57.6295 66.1568 172.0023 55 A 4.6513 8.4982 120.4356 50.6665 20.4659 178.5004 56 A 3.8292 8.2542 124.1428 55.2271 18.4998 179.1422 57 H 4.5453 8.3801 109.3807 57.0930 28.6959 175.3081 58 C 4.6541 7.7062 117.1678 57.1664 40.7477 173.4014 59 Y 4.1906 7.5084 121.5210 58.0833 38.7602 175.3480 60 K 3.7009 6.6316 123.9162 55.4145 34.8357 174.5753 61 S 4.2138 8.1757 119.0083 58.5827 64.3754 173.2700 62 G 3.6644 8.3212 106.6248 46.7235 0.0000 173.7887 63 I 4.3088 7.3891 119.2071 59.9183 39.5095 175.6103 64 Q 4.7090 8.7687 127.6784 54.1891 31.7425 174.1486 65 V 4.3202 8.9985 127.2455 61.9907 33.3346 174.5977 66 R 5.0724 8.7857 127.7595 54.7779 31.9893 175.5331 67 L 4.7160 9.1698 124.9470 52.7339 44.6507 177.4910 *69 G 3.8160 8.2175 107.1900 45.4740 0.0000 172.7378 70 E 4.4829 8.2834 118.3932 55.2102 30.3677 174.1047 71 D 4.8179 7.9540 117.8488 54.9587 44.3977 174.3159 72 N 5.0034 8.5700 120.5631 52.7607 39.2023 176.1761 73 I 4.0159 8.5416 120.1288 62.2802 37.8796 176.2785 74 N 4.7949 8.6999 118.0061 53.0850 39.3667 174.7840 75 V 4.3631 7.3638 116.1695 60.7699 34.6145 174.9614 76 V 4.2254 8.3657 125.7984 62.1908 31.1473 175.2431 77 E 4.4311 9.2957 127.1979 55.2990 30.8904 176.8035 78 G 3.9640 8.4483 105.9169 45.9541 0.0000 174.0978 79 N 4.6007 8.9514 116.1803 52.8488 36.8250 174.5275 80 E 4.5395 7.6346 116.8959 56.3334 30.8693 176.4480 81 Q 4.3334 8.9502 120.8842 54.4682 32.9119 173.9271 82 F 5.6035 8.7819 123.3457 56.0886 40.7865 175.4934 83 I 4.7098 8.8608 124.5985 59.3998 41.1441 175.2827 84 S 4.5767 8.6960 122.3146 58.1389 64.2835 173.2921 85 A 4.3053 8.5255 126.4145 52.2540 17.9394 177.6781 86 S 4.2847 9.1506 118.8074 60.5207 63.5466 174.3488 87 K 4.4625 7.4224 117.4892 55.4487 35.4115 174.0681 88 S 5.2150 8.9453 122.5174 56.9752 65.7155 173.6175 89 I 4.4202 9.3605 127.0789 59.5182 38.4003 175.0990 90 V 4.1661 8.2307 127.2806 62.2189 32.6225 175.1650 91 H 3.9262 8.6944 127.5097 55.8904 29.9097 174.2873 92 P 4.2001 0.0000 0.0000 65.5257 31.3280 177.0924 93 S 4.6519 7.8902 111.3284 58.0832 62.8390 173.3749 94 Y 4.3183 8.2509 123.8185 57.6977 39.1141 174.4851 95 N 4.6864 8.1368 125.3901 51.2410 40.2747 175.1582 96 S 4.1224 7.7994 120.5567 60.2231 63.4140 175.3572 97 N 4.3833 8.3917 118.9183 55.3090 38.5354 176.0820 98 T 3.9546 7.6818 105.6000 60.8021 69.9605 175.2755 99 L 3.7818 8.1320 120.7085 55.1101 39.9788 173.9000 100 N 4.4537 7.6100 118.6888 54.7137 39.3472 174.6659 101 N 4.6233 8.7501 120.5496 54.4876 35.8019 175.2719 102 D 4.6836 8.0326 117.6759 53.1758 39.4664 174.3972 103 I 4.7903 7.1592 120.9422 59.2737 42.3401 172.8966 104 M 5.4127 9.1303 126.8741 54.2120 36.2488 173.2045 105 L 5.3971 9.3553 125.2093 53.1849 44.8561 175.3614 106 I 4.9210 9.1503 123.9863 59.4259 40.3569 174.3622 107 K 3.6094 8.8389 129.1807 54.7960 33.4478 175.5890 108 L 4.3885 8.0953 127.9314 53.9560 42.0894 176.9093 109 K 4.1184 8.8089 125.3010 58.9781 32.5038 177.1426 110 S 4.6723 7.7407 110.9883 55.7044 66.1080 173.2060 111 A 4.3912 8.3971 123.3623 52.0729 18.7188 177.4110 112 A 4.2310 8.9766 123.6883 51.9460 19.7425 177.5803 113 S 4.5740 8.9275 116.6930 57.0840 63.5644 174.5086 114 L 4.5694 8.5011 125.9622 54.3720 41.4559 176.7236 115 N 4.7249 8.8459 120.2260 52.7170 39.5610 175.4390 116 S 4.4150 8.8076 112.1513 62.1293 63.2686 175.7439 117 R 4.0697 8.6984 119.6202 57.6681 30.3259 176.2410 118 V 4.6003 7.7715 116.9943 60.8890 33.6206 173.8112 119 A 5.1570 8.5065 128.1790 50.4573 22.9522 175.1550 120 S 5.0722 8.7019 114.0660 57.8308 64.7920 173.1475 121 I 4.4452 8.3039 121.2600 59.3283 39.8059 175.2894 122 S 4.5503 8.3016 122.9149 57.9175 64.3897 173.7003 123 L 4.3460 8.3405 123.0690 53.3013 42.4236 175.4365 124 P 4.4528 0.0000 0.0000 63.1707 32.1986 176.1753 125 T 4.1377 8.2838 109.2606 62.8094 70.0306 174.8148 *127 S 4.8290 7.5497 113.9999 57.9209 64.0257 174.0218 128 C 4.5547 8.4066 118.0724 56.7531 40.7038 173.4601 129 A 4.4224 8.1118 124.6129 51.3727 19.7029 177.3064 130 S 4.3959 8.0503 114.1761 56.6672 65.2262 173.1167 *132 A 4.2279 8.1628 122.9186 53.4332 19.1978 176.7949 133 G 4.0060 9.2189 110.4865 45.4155 0.0000 174.4738 134 T 3.8831 7.5474 117.1156 64.0333 69.4040 173.1905 135 Q 4.7136 8.5928 127.5756 55.5663 30.2397 175.2315 136 C 5.2821 9.2801 122.8999 55.0945 46.5414 172.2907 137 L 5.1946 8.9798 122.7808 53.6145 43.8253 175.0058 138 I 5.1731 9.2251 127.3827 58.8156 39.8725 174.8679 139 S 4.8763 8.5099 119.5576 56.5554 66.4762 173.0685 140 G 3.7702 7.4561 108.2155 46.2354 0.0000 173.0456 141 W 4.6073 8.7506 117.0576 56.2764 29.4323 177.0112 142 G 4.1410 8.2963 108.6738 44.2213 0.0000 173.5495 143 N 3.6616 8.7346 118.1985 54.4114 38.9252 174.4362 144 T 5.0882 8.2537 112.9929 60.3978 69.3655 174.0553 145 K 4.5549 7.7535 121.8332 54.6462 34.5907 176.0730 146 S 4.1988 8.9855 119.1553 61.0883 63.1703 175.1355 147 S 4.5233 8.9028 120.5447 56.2952 62.5149 173.9705 148 G 3.8055 7.2562 111.5665 44.4571 0.0000 170.0347 149 T 4.7672 7.8082 116.1290 62.2051 72.7333 174.1155 150 S 4.3465 9.2594 119.5072 58.0478 65.9143 172.7844 151 Y 4.8937 8.7038 125.9567 55.7321 39.2122 174.3236 152 P 4.7066 0.0000 0.0000 62.3416 33.0153 175.8438 153 D 4.5918 8.7523 118.7940 56.4906 41.4085 177.1758 154 V 5.5701 7.4000 109.8453 58.5776 34.3639 175.8414 155 L 3.1297 7.9786 125.1975 55.0721 42.8604 176.0748 156 K 4.8718 8.1760 125.3663 55.0422 34.9022 174.6909 157 C 5.2536 8.5598 119.2976 55.3175 41.2714 172.9250 158 L 4.9216 8.5292 121.5510 54.0910 45.6967 174.1092 159 K 5.1027 8.9946 125.6420 55.3949 33.4938 175.9415 160 A 4.7991 9.1901 126.7139 49.7008 23.0658 173.3829 161 P 4.9774 0.0000 0.0000 61.9524 33.7667 175.2741 162 I 4.2591 8.5025 123.2503 61.4153 38.0779 175.7852 163 L 4.8382 8.7840 127.4867 53.3171 43.3896 176.9513 164 S 4.3563 8.4261 115.0187 58.1206 63.9216 175.2213 165 D 4.4789 8.7141 122.2462 57.3336 40.5810 179.3593 166 S 4.1196 7.9976 114.6317 61.7381 63.1700 176.6866 167 S 4.1480 7.7995 118.4431 60.9513 62.4919 175.7602 168 C 4.2605 8.3294 121.2646 59.8704 39.8139 175.9719 169 K 3.9475 8.4236 119.8797 59.2591 31.3347 179.5688 170 S 4.1618 7.7662 114.7446 61.2019 62.8158 176.0481 171 A 4.0066 7.7066 122.9115 53.7245 19.7502 177.3910 172 Y 4.8009 7.7406 113.9466 54.9925 38.1487 172.6861 173 P 4.5987 0.0000 0.0000 63.3758 32.1338 177.0346 174 G 3.9995 9.0955 110.5008 46.1361 0.0000 173.5266 175 Q 4.5531 8.3398 117.2511 55.3244 30.7427 175.6626 176 I 4.3655 7.9248 119.4701 60.2316 38.3365 175.4331 177 T 4.5824 8.2480 115.5766 59.5506 70.9105 175.3571 178 S 4.3405 8.5654 115.2841 60.4313 63.1087 174.4693 179 N 5.0018 8.0797 118.9451 53.2751 38.5706 173.8056 180 M 5.6145 7.9530 116.5114 53.9290 36.3451 174.5401 181 F 5.1269 8.6540 114.6550 55.9042 42.0789 172.5353 182 C 5.4653 9.0569 116.9934 55.9207 38.2241 172.5682 183 A 5.0530 9.3827 123.1347 50.7856 22.3753 175.7915 184A G 3.7593 6.8966 108.0936 44.7328 0.0000 172.2672 184 Y 4.6478 8.4053 119.1929 56.0510 41.0562 176.4600 185 L 4.1839 8.6420 124.9257 56.8881 42.0310 178.3760 186 E 4.1970 8.2742 115.1576 56.3346 30.1986 177.2424 187 G 3.8213 7.8361 107.9155 45.1301 0.0000 172.5069 188A G 4.0539 9.4439 105.5842 44.7295 0.0000 173.5989 188 K 5.3252 7.1989 117.2102 54.0377 35.5880 175.2639 189 D 4.6513 8.3787 122.7789 53.7197 44.7703 174.7792 190 S 4.8626 8.7920 117.1122 58.2980 65.0733 172.8306 191 C 4.7289 9.2712 118.5794 55.5636 42.8899 172.2456 192 Q 4.2998 8.6500 118.7581 58.1139 28.4507 178.0922 193 G 4.5408 9.3244 110.7919 45.7213 0.0000 174.0168 194 D 4.6766 8.5944 118.9526 55.4833 41.7373 176.7542 195 S 4.4528 8.0755 115.3390 60.5114 63.3320 175.5639 196 G 4.2331 8.9155 112.5871 46.4056 0.0000 173.7660 197 G 4.3071 7.9748 107.4492 45.1963 0.0000 171.3491 198 P 5.0693 0.0000 0.0000 62.4343 33.4284 175.7003 199 V 4.3352 8.5659 121.0445 61.4261 34.1351 173.9042 200 V 4.7480 8.6620 128.8439 61.2810 33.7828 173.7005 201 C 5.1147 8.9985 125.3187 55.4553 43.5362 174.6558 202 S 3.7121 9.6046 120.9123 59.7761 59.9670 173.1197 203 G 3.9077 8.3113 103.4713 45.8200 0.0000 173.5011 204 K 4.6623 7.5942 118.0992 53.0317 34.9360 175.4380 *209 L 4.4302 8.3001 123.5350 55.3629 42.1834 175.6597 210 Q 4.4115 8.9353 126.4566 57.2377 30.7780 175.9089 211 G 5.3944 8.0161 104.2917 45.8507 0.0000 171.4077 212 I 5.2737 8.2031 119.3159 58.8813 41.0780 175.4111 213 V 3.5756 8.9693 127.3986 64.0092 31.7645 174.1320 214 S 4.8929 8.5381 121.2696 58.6232 64.4261 174.8022 215 W 5.1094 7.6762 114.2717 56.0516 32.0206 172.8456 216 G 3.9035 8.4049 106.5076 46.5919 0.0000 173.5371 217 S 4.6382 8.2222 116.1094 56.7203 62.0768 172.9672 *219 G 4.2325 7.9440 118.6147 45.5228 0.0000 170.7819 220 C 4.7865 8.2835 116.5993 56.6659 45.3345 173.7343 221A A 4.3166 8.9727 125.5390 53.1394 16.6003 176.9036 221 Q 4.5796 7.3769 117.0887 56.3439 29.7161 175.9826 222 K 4.1208 8.4415 122.6031 57.8551 32.7381 176.2410 223 N 4.3051 9.2690 121.8186 54.0535 36.8242 175.4233 224 K 4.3247 7.5833 117.5924 53.6716 32.5065 173.7229 225 P 4.6024 0.0000 0.0000 62.2279 33.0860 176.9201 226 G 3.7306 8.5481 107.3628 45.7594 0.0000 172.9093 227 V 4.4750 7.6751 122.5807 60.8276 33.9154 174.2015 228 Y 4.8588 8.1706 123.8849 55.9813 42.4960 174.8161 229 T 4.4600 8.6000 119.3224 63.5455 69.9638 174.5390 230 K 5.1332 9.3143 128.4964 55.5090 31.0840 177.0604 231 V 3.9502 8.8249 125.9505 65.8871 31.3871 174.8771 232 C 4.3151 8.3281 112.6295 58.3458 41.4850 174.9931 233 N 4.1864 8.0455 117.3960 54.7187 38.5339 175.6561 234 Y 4.8254 7.9243 117.3254 57.4582 38.7786 177.2537 235 V 3.7067 7.9546 121.6193 66.3245 31.5449 178.0167 236 S 4.1799 8.1062 113.3946 60.9900 62.9192 176.1007 237 W 4.1422 8.2881 131.4954 60.2784 30.5238 177.6150 238 I 3.2321 8.4721 120.0627 64.4073 36.5725 178.4627 239 K 3.7487 7.9761 118.9104 59.6109 32.0047 179.5250 240 Q 3.8684 8.0505 118.1895 59.1052 28.3883 178.9029 241 T 3.5549 7.3450 115.9516 66.5203 68.7864 176.5383 242 I 2.8008 7.3407 121.7416 63.9493 36.7475 178.3910 243 A 3.9961 7.7572 120.8459 54.3675 18.2438 178.7746 244 S 4.5646 7.5356 109.5328 58.4665 63.6546 174.1389 245 N 4.6813 7.8195 125.1720 53.7535 39.0308 174.0266 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 16 I 7.88 4.27 1.80 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 1.34 0.66 0.90 0.00 0.00 17 V 8.69 4.18 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 1.02 0.00 0.00 1.00 0.00 0.00 18 G 8.45 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 0.00 0.00 0.00 19 G 7.74 4.15 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 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 7.92 4.96 0.00 2.95 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 21 T 8.57 4.24 4.29 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 1.22 0.00 0.00 22 C 8.64 4.27 0.00 2.73 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 23 G 8.62 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 24 A 8.61 4.15 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 25 N 8.90 4.27 0.00 2.87 2.92 0.00 0.00 7.17 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 26 T 7.59 4.19 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 1.25 0.00 0.00 27 V 7.08 4.14 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 0.25 0.00 0.00 0.75 0.00 0.00 28 P 0.00 4.57 0.00 2.41 2.46 0.00 3.92 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.00 0.00 29 Y 7.03 5.02 0.00 3.29 3.40 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 30 Q 7.20 4.59 0.00 1.73 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.72 0.00 0.00 0.00 0.00 0.00 1.88 2.47 0.00 31 V 8.97 4.85 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 0.96 0.00 0.00 0.96 0.00 0.00 32 S 8.62 4.73 0.00 3.02 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 33 L 8.54 4.39 0.00 0.57 0.78 0.76 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.95 5.81 0.00 2.40 2.46 0.00 0.00 6.77 8.42 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 *37 S 8.38 4.36 0.00 3.82 3.74 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 38 G 9.86 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 39 Y 6.73 4.49 0.00 3.03 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 40 H 8.90 4.61 0.00 2.85 3.17 0.00 5.86 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.84 4.99 0.00 3.01 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 42 C 6.74 4.81 0.00 2.27 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 43 G 8.75 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 7.69 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.69 5.41 0.00 3.85 3.87 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 46 L 9.34 4.86 0.00 1.85 1.68 1.08 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.57 4.37 1.90 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 1.63 0.89 0.97 0.00 0.00 48 N 7.66 4.80 0.00 3.00 3.00 0.00 0.00 6.03 7.64 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 49 S 8.71 4.35 0.00 4.19 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 50 Q 8.99 4.63 0.00 2.05 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.79 0.00 0.00 0.00 0.00 0.00 2.18 2.29 0.00 51 W 8.45 5.56 0.00 3.37 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 52 V 9.15 5.07 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 1.11 0.00 0.00 0.98 0.00 0.00 53 V 8.97 4.93 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 0.98 0.00 0.00 1.03 0.00 0.00 54 S 9.07 5.15 0.00 3.90 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 55 A 8.50 4.65 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 56 A 8.25 3.83 0.37 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 57 H 8.38 4.55 0.00 3.36 3.51 0.00 5.55 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.71 4.65 0.00 3.21 3.28 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 59 Y 7.51 4.19 0.00 2.99 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 60 K 6.63 3.70 0.00 1.27 1.16 0.00 0.91 0.00 0.00 1.26 0.00 0.00 2.56 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.88 1.00 7.81 61 S 8.18 4.21 0.00 3.96 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 62 G 8.32 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 I 7.39 4.31 1.85 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 1.41 0.66 0.91 0.00 0.00 64 Q 8.77 4.71 0.00 2.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.89 0.00 0.00 0.00 0.00 0.00 2.08 2.20 0.00 65 V 9.00 4.32 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 0.97 0.00 0.00 0.89 0.00 0.00 66 R 8.79 5.07 0.00 1.56 1.74 0.00 2.21 0.00 0.00 2.60 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.97 0.00 0.00 77 E 9.30 4.43 0.00 1.97 1.96 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 2.27 2.40 0.00 78 G 8.45 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 79 N 8.95 4.60 0.00 2.94 3.10 0.00 0.00 6.90 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 E 7.63 4.54 0.00 1.54 1.69 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 2.63 2.45 0.00 81 Q 8.95 4.33 0.00 1.99 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.78 0.00 0.00 0.00 0.00 0.00 2.23 2.30 0.00 82 F 8.78 5.60 0.00 2.82 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 83 I 8.86 4.71 1.88 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 1.25 0.85 0.93 0.00 0.00 84 S 8.70 4.58 0.00 3.75 3.74 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 85 A 8.53 4.31 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 86 S 9.15 4.28 0.00 3.82 3.84 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 87 K 7.42 4.46 0.00 1.77 1.45 0.00 1.80 0.00 0.00 1.89 0.00 0.00 2.82 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.42 1.45 7.81 88 S 8.95 5.22 0.00 4.10 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 89 I 9.36 4.42 2.06 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.00 1.07 0.00 0.00 90 V 8.23 4.17 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 0.64 0.00 0.00 0.73 0.00 0.00 91 H 8.69 3.93 0.00 2.82 3.05 0.00 5.66 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.20 0.00 2.04 2.15 0.00 3.32 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.23 0.00 93 S 7.89 4.65 0.00 3.93 3.89 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 0.00 0.00 0.00 94 Y 8.25 4.32 0.00 3.09 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 95 N 8.14 4.69 0.00 2.58 2.43 0.00 0.00 6.65 7.55 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 96 S 7.80 4.12 0.00 3.93 3.84 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 97 N 8.39 4.38 0.00 2.70 2.78 0.00 0.00 6.91 8.18 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 98 T 7.68 3.95 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 1.09 0.00 0.00 99 L 8.13 3.78 0.00 1.38 1.83 1.04 0.55 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 0.00 100 N 7.61 4.45 0.00 2.70 2.65 0.00 0.00 7.25 6.60 0.00 0.00 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 N 8.75 4.62 0.00 2.93 2.66 0.00 0.00 7.24 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 0.00 102 D 8.03 4.68 0.00 3.08 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 7.16 4.79 1.39 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 1.31 1.17 0.14 0.00 0.00 104 M 9.13 5.41 0.00 2.26 1.83 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.64 0.00 105 L 9.36 5.40 0.00 1.79 1.92 0.25 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.15 4.92 1.92 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 1.19 0.96 0.94 0.00 0.00 107 K 8.84 3.61 0.00 0.79 1.11 0.00 1.36 0.00 0.00 1.36 0.00 0.00 2.64 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.73 0.21 7.81 108 L 8.10 4.39 0.00 1.47 1.57 0.91 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.81 4.12 0.00 1.84 1.80 0.00 1.71 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.36 7.81 110 S 7.74 4.67 0.00 3.93 3.74 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 0.00 111 A 8.40 4.39 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 0.00 112 A 8.98 4.23 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 0.00 113 S 8.93 4.57 0.00 3.76 3.84 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 0.00 114 L 8.50 4.57 0.00 1.66 1.63 0.96 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.85 4.72 0.00 2.88 2.87 0.00 0.00 6.75 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 S 8.81 4.42 0.00 3.90 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 0.00 117 R 8.70 4.07 0.00 1.90 1.99 0.00 3.24 0.00 0.00 3.11 7.36 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.55 4.83 0.00 4.00 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 0.00 128 C 8.41 4.55 0.00 2.93 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 0.00 129 A 8.11 4.42 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.05 4.40 0.00 3.98 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 *132 A 8.16 4.23 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 0.00 133 G 9.22 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 0.00 134 T 7.55 3.88 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 1.14 0.00 0.00 135 Q 8.59 4.71 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.81 0.00 0.00 0.00 0.00 0.00 2.32 2.46 0.00 136 C 9.28 5.28 0.00 2.77 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 L 8.98 5.19 0.00 1.76 1.58 1.02 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.23 5.17 1.89 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.90 1.00 0.00 0.00 139 S 8.51 4.88 0.00 3.53 3.58 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 0.00 140 G 7.46 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 0.00 0.00 0.00 141 W 8.75 4.61 0.00 3.06 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 G 8.30 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 0.00 143 N 8.73 3.66 0.00 2.27 2.62 0.00 0.00 7.09 7.63 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 0.00 144 T 8.25 5.09 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 1.27 0.00 0.00 145 K 7.75 4.55 0.00 1.77 1.70 0.00 1.59 0.00 0.00 1.72 0.00 0.00 3.14 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.29 1.41 7.81 146 S 8.99 4.20 0.00 4.10 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 0.00 147 S 8.90 4.52 0.00 3.85 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 0.00 148 G 7.26 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 0.00 149 T 7.81 4.77 4.29 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 1.32 0.00 0.00 150 S 9.26 4.35 0.00 3.78 3.60 0.00 0.00 0.00 0.00 0.00 0.00 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 8.70 4.89 0.00 2.99 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 0.00 152 P 0.00 4.71 0.00 2.46 2.09 0.00 4.12 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 2.18 2.04 0.00 153 D 8.75 4.59 0.00 2.84 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 0.00 154 V 7.40 5.57 2.26 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 1.05 0.00 0.00 0.97 0.00 0.00 155 L 7.98 3.13 0.00 1.20 1.23 -0.61 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.18 4.87 0.00 1.67 1.51 0.00 1.60 0.00 0.00 1.55 0.00 0.00 2.81 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.28 1.47 7.81 157 C 8.56 5.25 0.00 1.57 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 0.00 0.00 0.00 158 L 8.53 4.92 0.00 1.72 1.47 1.02 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 159 K 8.99 5.10 0.00 1.82 1.83 0.00 1.86 0.00 0.00 1.85 0.00 0.00 2.78 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.62 1.47 7.81 160 A 9.19 4.80 1.20 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 0.00 0.00 161 P 0.00 4.98 0.00 2.02 2.26 0.00 3.04 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 1.74 1.72 0.00 162 I 8.50 4.26 1.87 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.80 0.78 0.00 0.00 163 L 8.78 4.84 0.00 1.54 1.60 0.92 0.73 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 0.00 164 S 8.43 4.36 0.00 4.00 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 0.00 165 D 8.71 4.48 0.00 2.77 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 0.00 166 S 8.00 4.12 0.00 4.05 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 0.00 167 S 7.80 4.15 0.00 4.04 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 C 8.33 4.26 0.00 3.20 3.32 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 0.00 169 K 8.42 3.95 0.00 1.93 1.90 0.00 1.75 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.67 7.81 170 S 7.77 4.16 0.00 4.04 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 0.00 171 A 7.71 4.01 1.06 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 0.00 172 Y 7.74 4.80 0.00 3.14 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 0.00 173 P 0.00 4.60 0.00 2.08 2.07 0.00 3.89 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.21 0.00 174 G 9.10 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 0.00 175 Q 8.34 4.55 0.00 2.49 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.45 6.66 0.00 0.00 0.00 0.00 0.00 2.28 2.55 0.00 176 I 7.92 4.37 1.99 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.95 1.01 0.00 0.00 177 T 8.25 4.58 4.28 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 1.25 0.00 0.00 178 S 8.57 4.34 0.00 4.01 4.05 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 0.00 179 N 8.08 5.00 0.00 2.84 3.09 0.00 0.00 6.60 8.04 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 0.00 180 M 7.95 5.61 0.00 1.91 2.01 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.63 0.00 181 F 8.65 5.13 0.00 3.08 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 0.00 182 C 9.06 5.47 0.00 2.99 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 0.00 183 A 9.38 5.05 1.16 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 184A G 6.90 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 0.00 0.00 0.00 184 Y 8.41 4.65 0.00 3.07 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 0.00 185 L 8.64 4.18 0.00 1.73 1.72 0.91 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.27 4.20 0.00 2.10 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 2.31 2.27 0.00 187 G 7.84 3.82 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 0.00 0.00 0.00 188A G 9.44 4.05 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 0.00 0.00 0.00 188 K 7.20 5.33 0.00 1.25 1.64 0.00 1.64 0.00 0.00 2.11 0.00 0.00 2.16 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.03 7.81 189 D 8.38 4.65 0.00 2.82 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 0.00 190 S 8.79 4.86 0.00 3.99 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 0.00 191 C 9.27 4.73 0.00 2.94 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 0.00 192 Q 8.65 4.30 0.00 2.31 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.18 0.00 0.00 0.00 0.00 0.00 2.57 2.58 0.00 193 G 9.32 4.54 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 0.00 0.00 0.00 194 D 8.59 4.68 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 0.00 195 S 8.08 4.45 0.00 3.96 3.84 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 0.00 196 G 8.92 4.23 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 0.00 197 G 7.97 4.31 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 0.00 0.00 0.00 198 P 0.00 5.07 0.00 2.38 2.41 0.00 3.70 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.19 0.00 199 V 8.57 4.34 2.26 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 0.91 0.00 0.00 0.62 0.00 0.00 200 V 8.66 4.75 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 0.74 0.00 0.00 0.66 0.00 0.00 201 C 9.00 5.11 0.00 2.76 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 0.00 202 S 9.60 3.71 0.00 3.95 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 G 8.31 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 0.00 0.00 0.00 204 K 7.59 4.66 0.00 1.95 1.62 0.00 1.55 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.30 1.37 7.81 *209 L 8.30 4.43 0.00 1.52 1.74 1.07 0.79 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 0.00 210 Q 8.94 4.41 0.00 1.97 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.36 0.00 0.00 0.00 0.00 0.00 2.41 2.33 0.00 211 G 8.02 5.39 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 0.00 212 I 8.20 5.27 1.93 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 1.31 0.79 0.96 0.00 0.00 213 V 8.97 3.58 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 0.96 0.00 0.00 1.18 0.00 0.00 214 S 8.54 4.89 0.00 3.90 3.82 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 0.00 215 W 7.68 5.11 0.00 3.38 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 0.00 216 G 8.40 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 0.00 217 S 8.22 4.64 0.00 4.22 4.04 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 0.00 0.00 0.00 *219 G 7.94 4.23 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 0.00 220 C 8.28 4.79 0.00 2.95 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 221A A 8.97 4.32 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 0.00 221 Q 7.38 4.58 0.00 1.96 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.94 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 222 K 8.44 4.12 0.00 1.72 1.72 0.00 1.92 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.55 7.81 223 N 9.27 4.31 0.00 2.82 2.83 0.00 0.00 6.77 7.53 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 0.00 224 K 7.58 4.32 0.00 1.66 1.79 0.00 1.62 0.00 0.00 1.38 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.52 7.81 225 P 0.00 4.60 0.00 2.13 2.11 0.00 3.58 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.99 0.00 226 G 8.55 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 0.00 0.00 0.00 227 V 7.68 4.48 0.67 0.00 0.00 0.00 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 -0.75 0.00 0.00 228 Y 8.17 4.86 0.00 1.43 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 0.00 229 T 8.60 4.46 4.30 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 1.22 0.00 0.00 230 K 9.31 5.13 0.00 2.13 1.91 0.00 1.81 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.55 1.66 7.81 231 V 8.82 3.95 2.44 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 1.22 0.00 0.00 1.14 0.00 0.00 232 C 8.33 4.32 0.00 3.17 3.23 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 0.00 233 N 8.05 4.19 0.00 2.35 2.37 0.00 0.00 6.83 7.45 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 0.00 234 Y 7.92 4.83 0.00 3.11 3.21 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 0.00 235 V 7.95 3.71 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 1.11 0.00 0.00 1.08 0.00 0.00 236 S 8.11 4.18 0.00 4.13 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 0.00 237 W 8.29 4.14 0.00 3.55 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 I 8.47 3.23 2.05 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 1.65 1.08 0.77 0.00 0.00 239 K 7.98 3.75 0.00 1.74 1.78 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.61 7.81 240 Q 8.05 3.87 0.00 1.97 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.62 0.00 241 T 7.35 3.55 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 242 I 7.34 2.80 1.35 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.28 0.30 0.00 0.00 243 A 7.76 4.00 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 0.00 244 S 7.54 4.56 0.00 4.05 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 0.00 245 N 7.82 4.68 0.00 3.08 3.02 0.00 0.00 6.76 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 * Residues marked with a * may have inaccurate shift predictions.