NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.0783 8.1227 122.4204 51.7146 21.2573 176.3364 2 V 4.2898 8.1676 115.6316 60.6760 32.1587 173.8534 3 S 4.8824 9.3550 122.2217 56.4792 67.0632 172.0440 4 L 5.1046 8.3653 122.3520 53.3680 43.9564 175.8175 5 D 4.8318 8.5805 122.6938 54.2883 39.8544 175.8426 6 R 4.6200 7.6755 114.4408 55.9364 31.9307 174.6814 7 T 4.4403 8.2440 107.6150 61.7242 69.6239 174.3708 8 R 4.7950 7.2942 116.2368 55.5093 32.1354 173.9432 9 A 4.7626 8.8327 122.0085 50.1655 22.6276 175.0815 10 V 4.8237 8.5027 121.3876 61.1589 33.7238 174.6871 11 F 4.3922 9.4318 132.2004 56.7474 40.6966 174.3335 12 D 4.6390 8.3572 127.5223 53.9593 41.4101 177.0186 13 G 3.9025 9.0847 117.1010 47.5132 0.0000 173.2522 14 S 4.5048 8.5362 113.9008 58.6037 63.6005 173.6289 15 E 4.7772 8.1206 122.5567 55.1254 32.1622 176.7603 16 K 4.3765 8.5106 121.5204 57.1838 32.2645 177.3611 17 S 5.0817 7.5943 109.8660 58.7796 65.7938 173.5603 18 M 4.8630 9.0318 117.0347 54.3853 34.6830 173.6258 19 T 5.0868 8.3141 108.7532 59.8291 72.1449 173.0966 20 L 4.7042 8.8166 122.9536 52.9925 45.1547 175.5372 21 D 5.1369 8.9222 124.0367 53.9882 42.4334 175.4430 22 I 5.2005 8.4039 115.5373 59.5451 41.7902 174.0151 23 S 4.8934 8.6363 115.3164 57.3285 66.2883 172.9381 24 N 4.9811 9.1912 126.7933 52.6950 38.8748 174.7690 25 D 4.6270 9.0209 126.3674 55.1305 41.8645 176.1994 26 N 4.5117 8.4532 122.4794 53.2521 39.7792 175.9022 27 K 4.4034 8.7266 126.8710 54.5863 32.2282 173.0894 28 Q 4.5911 8.4184 118.3183 57.4619 30.8449 175.6127 29 L 5.0844 8.4325 115.6425 52.0593 45.0896 174.5847 30 P 4.9905 0.0000 0.0000 62.4727 32.7260 174.8034 31 Y 4.7265 8.9083 119.7496 56.2442 41.9309 174.7356 32 L 5.0566 8.5906 121.9485 53.6857 44.6360 175.6881 33 A 5.1262 9.1537 123.3757 50.4211 21.8751 175.0154 34 Q 5.2010 9.4186 121.2715 55.2515 31.3780 174.8094 35 A 5.6007 9.3178 122.7461 49.2594 23.0785 174.8368 36 W 5.0123 7.6505 115.6586 56.0008 31.7289 173.0018 37 I 5.1703 8.5725 120.1844 59.7611 40.2533 174.6254 38 E 5.3771 9.0520 122.8115 54.8310 34.2771 176.3353 39 N 5.0695 9.0866 120.2351 51.9499 39.4577 175.3576 40 E 4.0128 8.5645 114.9414 59.3300 28.9092 177.1436 41 N 4.7929 8.8587 116.6501 52.5483 38.6183 175.0669 42 Q 3.3954 8.0173 115.4243 56.9884 26.9453 173.1342 43 E 4.6530 7.6662 113.6545 54.3189 31.1859 176.3112 44 K 4.7567 8.5856 123.0054 56.4941 32.8316 176.4130 45 I 4.7708 8.3131 115.3583 59.1914 40.3712 175.1215 46 I 4.4552 8.3260 119.6718 61.3345 39.8866 175.9515 47 T 4.2509 9.2268 107.4985 61.1809 69.2839 174.1567 48 G 4.0880 7.6370 108.4080 42.9976 0.0000 171.3354 49 P 4.9948 0.0000 0.0000 62.7629 32.3500 175.7979 50 V 4.6666 7.3420 120.3675 61.0725 34.0800 174.4305 51 I 4.7828 9.2555 120.7232 58.9490 41.1169 173.9329 52 A 5.4761 8.6828 124.9466 50.4577 21.3810 175.7134 53 T 4.8212 9.0481 112.7705 59.2444 72.1302 171.8979 54 P 4.9179 0.0000 0.0000 61.6091 32.6446 174.3439 55 P 4.7062 0.0000 0.0000 64.9405 32.4257 176.5650 56 V 5.1849 7.6141 117.2272 61.6367 34.7376 173.9955 57 Q 4.7092 8.7659 122.8239 55.0736 32.2331 173.0629 58 R 4.6632 8.5818 121.9247 55.5837 31.6475 175.2563 59 L 4.8050 8.7822 126.0964 52.7819 44.4230 176.2814 60 E 4.5984 8.8461 123.6896 54.9905 31.1509 174.7959 61 P 4.5545 0.0000 0.0000 64.5982 31.3964 177.0050 62 G 3.9128 8.8015 109.5230 44.8822 0.0000 173.6010 63 A 4.2805 8.1163 122.4968 51.8301 19.6008 176.9339 64 K 4.8341 8.4308 118.9995 55.1824 35.3762 176.2226 65 S 4.5363 8.4386 117.3013 59.1404 66.1969 172.1892 66 M 4.9317 8.2862 114.1381 55.0042 33.9077 174.1740 67 V 4.6067 8.7629 119.4549 61.1128 34.9298 173.9203 68 R 4.9959 9.3812 128.1174 54.7592 32.3293 174.4573 69 L 5.3654 9.2016 126.5766 53.2171 44.0090 175.7155 70 S 5.3964 9.1003 117.5890 57.0077 66.9124 172.9587 71 T 5.0039 8.1595 110.5078 60.4874 71.2340 173.9958 72 T 4.4243 8.1427 113.7298 59.5789 71.6612 173.7648 73 P 4.2670 0.0000 0.0000 65.7576 31.5827 178.5278 74 D 4.5140 8.0621 117.0102 56.1435 41.1935 178.0242 75 I 3.5013 7.6873 120.3706 63.7471 38.0226 177.9041 76 S 4.2751 7.7506 113.7549 60.7777 62.7588 175.6371 77 K 4.1339 7.8150 119.7068 58.3341 32.0307 177.5018 78 L 4.2933 7.5414 118.6449 53.3298 42.2037 175.1429 79 P 4.3812 0.0000 0.0000 63.3963 31.6813 176.6026 80 Q 4.5910 8.6351 119.2221 55.8892 29.3326 175.6920 81 D 4.8567 7.6455 116.3390 52.3484 39.8314 175.3918 82 R 4.3295 7.1768 113.4450 55.4936 31.5763 174.0221 83 E 4.6351 8.4945 119.1694 56.5141 30.6030 176.5255 84 S 5.0208 9.0855 117.1008 56.8285 66.5962 172.8723 85 L 4.5074 8.4155 125.3080 53.7357 43.5082 175.1664 86 F 5.0205 8.7318 123.3478 56.1236 44.3913 172.7977 87 Y 4.9999 9.1978 116.2976 56.4040 41.8725 174.6728 88 F 5.0970 9.1897 125.9734 56.6175 41.9457 174.0357 89 N 4.7954 7.2193 122.1909 50.8875 42.0577 173.2780 90 L 4.6942 8.2997 124.4643 53.3162 45.2250 174.7079 91 R 5.1878 9.0197 127.9817 54.3909 32.6969 174.7682 92 E 4.9755 8.8131 124.5258 55.7635 31.8836 176.2727 93 I 4.5971 8.6927 121.8437 58.6092 39.5873 173.4694 94 P 3.9185 0.0000 0.0000 61.3436 32.0964 174.5559 95 P 4.1702 0.0000 0.0000 62.9265 31.8449 176.1576 96 R 3.9727 8.5263 122.6904 56.1993 30.2161 176.1956 97 S 4.7179 8.4074 117.9338 57.1746 64.7483 173.6684 98 E 4.6393 8.3705 120.5738 56.1243 29.8423 176.5693 99 K 4.1189 7.4639 117.9844 56.1644 32.6791 177.1120 100 A 4.1453 8.3837 124.9950 53.0098 19.7541 177.2181 101 N 4.1394 8.5534 116.3341 54.7446 35.9650 173.4915 102 V 4.5638 7.2210 109.1521 59.2623 36.1281 175.3012 103 L 4.7387 8.3175 122.1455 53.1764 44.3539 175.2531 104 Q 4.6460 8.6043 125.8595 54.2037 31.4715 174.2288 105 I 4.2908 8.3544 125.1844 59.5518 38.7307 174.8533 106 A 4.6788 8.3627 127.6680 49.8658 20.6482 175.3556 107 L 4.2490 9.1129 126.0064 55.6234 43.5334 175.6098 108 Q 4.9461 8.5694 125.7750 54.6661 31.9273 174.0394 109 T 4.5653 8.9703 123.6316 61.6773 70.9085 173.3262 110 K 4.9266 8.6752 127.5772 54.5313 34.4984 174.9244 111 I 4.7985 8.5757 120.3916 58.6635 41.4351 174.9449 112 K 3.7573 8.3800 122.2014 56.0603 33.4935 176.0502 113 L 4.7411 8.3099 126.0943 53.2489 44.5798 175.0269 114 F 5.0832 8.8821 127.1101 56.6606 40.4807 174.6532 115 Y 4.7851 9.3854 127.0785 57.1106 40.0701 174.1221 116 R 4.4007 8.5411 128.6243 53.4016 31.8746 173.4298 117 P 4.3034 0.0000 0.0000 62.3011 32.1206 177.2839 118 A 3.9093 8.7707 122.2682 55.4655 18.3500 179.9458 119 A 4.0336 8.0907 117.2297 54.4493 18.4585 177.9598 120 I 4.4578 7.2636 108.0291 60.1442 37.9072 175.8077 121 K 3.9915 7.9147 121.9546 57.6286 32.4561 175.8937 122 T 4.8616 8.1137 113.6294 59.7985 71.7366 173.7729 123 R 4.4303 8.6932 121.3827 54.2956 31.3821 174.6683 124 P 4.5719 0.0000 0.0000 64.5760 31.5358 176.6140 125 N 4.6014 9.5905 119.8299 53.3097 36.7147 174.2923 126 E 4.0113 8.1115 119.4096 56.2644 30.1720 176.3788 127 V 3.8356 8.2779 124.4482 60.8333 33.3297 174.8380 128 W 4.7070 7.0698 123.9077 56.5727 29.8025 177.9531 129 Q 3.8055 6.9043 118.3616 58.3796 28.0520 177.2263 130 D 4.5849 7.7846 115.0184 54.0033 39.2849 176.5634 131 Q 4.4187 7.6919 117.6594 56.0485 29.3599 175.9534 132 L 4.5758 7.5229 118.2150 55.0353 42.6577 176.6616 133 I 4.9805 8.4776 121.0970 59.7017 41.2367 174.2435 134 L 4.9240 8.9891 126.7717 53.1224 44.0183 175.1449 135 N 5.4630 8.8360 121.1553 51.0034 41.2052 174.0253 136 K 4.0354 9.3148 127.1418 56.8153 33.2579 176.3511 137 V 4.3439 8.3849 118.8666 59.9411 36.1113 173.5893 138 S 4.2237 8.4089 117.1453 60.7034 62.9008 173.7304 139 G 4.2484 9.5975 113.6316 45.2014 0.0000 173.2208 140 G 4.4741 6.4364 109.7319 46.0704 0.0000 173.9923 141 Y 5.1746 8.9848 122.4800 55.8314 42.3367 173.6680 142 R 4.7737 9.0181 122.6965 54.9302 31.9341 174.7311 143 I 4.6931 9.0189 128.9987 60.6179 39.0840 174.8602 144 E 4.9116 9.2715 126.9449 54.7198 32.1051 174.5837 145 N 4.9074 9.5285 124.2484 51.3258 39.9873 172.7811 146 P 4.5259 0.0000 0.0000 63.2483 32.4561 176.9034 147 T 4.2287 7.7774 110.5648 60.7743 69.7470 173.0290 148 P 4.4559 0.0000 0.0000 62.9223 31.5059 174.7064 149 Y 4.9969 6.8857 115.4968 56.2917 40.8970 175.0958 150 Y 4.3505 8.9953 119.6653 58.0219 39.1276 175.5428 151 V 4.4551 8.8816 122.8883 61.5252 35.0247 174.2353 152 T 5.0411 8.7224 124.9059 62.2455 70.3214 173.7346 153 V 4.7253 9.0388 128.9244 61.9310 32.4961 176.0700 154 I 4.7390 8.7205 120.8026 60.8760 38.9725 175.6374 155 G 4.3279 7.2243 108.8908 45.6187 0.0000 172.3306 156 L 4.4594 7.7718 121.7233 54.5113 44.4346 173.6257 157 G 3.1958 8.3048 114.6564 45.3327 0.0000 172.2739 158 G 4.0480 8.1564 107.6406 46.1319 0.0000 173.9614 159 S 3.8576 7.1261 114.0200 55.2962 67.2204 174.3622 160 E 3.5227 7.2767 122.4279 59.3738 29.2124 178.8215 161 K 3.8197 7.7189 118.9301 59.5682 32.2016 178.3149 162 Q 3.8494 7.8398 119.6281 58.9010 28.9262 177.9703 163 A 3.9130 7.9551 122.1259 55.0034 18.1615 179.4411 164 E 3.9547 8.0394 116.2550 58.4996 29.7677 177.6681 165 E 4.5275 8.1837 116.1688 56.2036 31.5514 176.8890 166 G 3.7725 8.0399 108.0494 45.0405 0.0000 172.8632 167 E 4.1738 8.6052 122.5523 55.6883 30.2404 176.1401 168 F 4.7022 8.4094 127.1901 56.7540 42.4446 173.2111 169 E 4.0553 7.8996 128.9203 55.3753 28.7135 175.8260 170 T 4.5295 8.4676 122.9262 64.6217 69.1543 174.0488 171 V 4.6554 9.0534 124.0993 60.2112 35.3877 173.6671 172 M 5.2734 8.8224 122.1488 53.9475 34.6738 174.4068 173 L 4.7166 9.1741 126.6066 53.3999 43.5980 176.8260 174 S 4.2404 8.6778 119.7287 57.2994 63.8557 172.2596 175 P 4.1780 0.0000 0.0000 63.0417 31.6484 176.7560 176 R 3.6909 8.1327 120.2603 56.9221 28.1929 174.2149 177 S 4.8131 8.0440 112.1496 57.7676 67.4013 173.9920 178 E 5.2206 8.4508 115.3623 55.9151 32.0667 174.1971 179 Q 4.6632 9.2127 121.7525 55.1044 33.3605 173.1863 180 T 5.1525 8.5061 119.6559 61.8883 70.7829 174.0898 181 V 4.4993 9.3873 128.5140 61.3017 34.7253 175.3801 182 K 4.5687 8.7311 131.3578 55.5721 32.4309 173.6652 183 S 4.7906 9.4967 118.4994 56.5973 66.3881 174.5756 184 A 4.3621 8.6041 127.4217 51.4189 19.0813 176.8827 185 N 4.4748 8.0250 118.1445 53.2683 39.7778 174.1716 186 Y 4.9074 8.5864 121.7724 56.0292 41.2440 174.7865 187 N 4.4901 9.4241 124.2876 56.7661 39.0481 175.4247 188 T 4.7240 7.5744 110.8780 58.3420 68.9653 170.4180 189 P 4.6714 0.0000 0.0000 63.9364 33.0512 174.9087 190 Y 5.0967 9.0207 120.2865 56.1275 41.0493 174.3805 191 L 5.1062 9.1820 125.1942 53.2375 45.6674 174.8877 192 S 5.3250 8.6196 120.1730 56.7484 65.5414 172.1456 193 Y 5.3629 8.0153 122.4123 55.7060 42.1898 173.4432 194 I 4.9629 8.3404 120.6312 59.7643 38.9629 176.2350 195 N 4.8095 8.6931 125.2677 51.2769 39.1767 175.4047 196 D 4.3011 8.3111 117.1038 57.3579 40.6352 177.3818 197 Y 4.4343 7.6135 113.7671 57.7941 38.3857 176.2223 198 G 3.9265 8.5570 108.6689 45.3423 0.0000 173.9772 199 G 4.0077 8.6421 109.3749 44.6624 0.0000 173.8204 200 R 5.6387 7.6702 116.7897 52.2997 30.4029 173.7121 201 P 4.3536 0.0000 0.0000 62.2661 33.3101 175.6671 202 V 4.7618 8.1039 120.6301 61.1807 34.1331 174.4806 203 L 4.8134 9.5621 128.1307 53.0456 44.7721 175.1862 204 S 4.3239 8.4364 117.8238 56.9465 63.7646 172.7297 205 F 5.0308 8.5133 125.9634 55.8545 41.5049 175.2756 206 I 4.6551 8.7608 121.7085 59.8798 40.4988 174.1837 207 C 5.3965 8.9066 123.1481 55.5814 39.5533 173.7152 208 N 4.7620 8.9674 119.4734 52.7442 40.5393 175.4494 209 G 4.1084 8.2553 118.4836 46.7206 0.0000 173.4341 210 S 4.5429 8.7591 121.9411 57.9844 63.4804 172.4953 211 R 5.0122 7.7533 122.9552 54.8372 31.7265 174.0144 212 C 5.7215 9.7839 124.5133 55.2726 42.3391 173.2823 213 S 5.2687 9.0273 116.6510 56.0799 66.7776 173.3994 214 V 3.1826 7.8266 120.6588 62.4175 31.8447 175.7099 215 K 3.6527 8.6494 129.3770 58.0429 31.8684 177.7903 216 K 3.8658 8.8475 129.0948 57.9018 32.1950 174.2455 *217 E 4.2236 8.0114 118.9650 55.8826 30.3413 177.1470 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 8.12 4.08 0.29 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 2 V 8.17 4.29 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 0.79 0.00 0.00 1.02 0.00 0.00 3 S 9.35 4.88 0.00 3.86 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 4 L 8.37 5.10 0.00 1.72 1.62 1.01 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 5 D 8.58 4.83 0.00 2.75 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 6 R 7.68 4.62 0.00 1.91 1.91 0.00 2.95 0.00 0.00 3.34 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.69 0.00 7 T 8.24 4.44 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 1.24 0.00 0.00 8 R 7.29 4.80 0.00 1.87 1.97 0.00 3.05 0.00 0.00 3.50 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.76 0.00 9 A 8.83 4.76 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 10 V 8.50 4.82 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 0.88 0.00 0.00 1.07 0.00 0.00 11 F 9.43 4.39 0.00 3.27 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 12 D 8.36 4.64 0.00 2.71 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 13 G 9.08 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 14 S 8.54 4.50 0.00 3.98 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 15 E 8.12 4.78 0.00 1.76 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.23 0.00 16 K 8.51 4.38 0.00 1.68 1.81 0.00 1.83 0.00 0.00 1.87 0.00 0.00 2.91 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.43 0.99 7.81 17 S 7.59 5.08 0.00 4.11 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 18 M 9.03 4.86 0.00 1.64 1.97 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.45 0.00 19 T 8.31 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 1.19 0.00 0.00 20 L 8.82 4.70 0.00 1.29 1.37 -0.13 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 21 D 8.92 5.14 0.00 2.78 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 I 8.40 5.20 1.92 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.84 0.99 0.00 0.00 23 S 8.64 4.89 0.00 3.91 3.68 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 24 N 9.19 4.98 0.00 2.90 2.73 0.00 0.00 7.05 8.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 D 9.02 4.63 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 26 N 8.45 4.51 0.00 2.50 2.74 0.00 0.00 7.18 6.29 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 27 K 8.73 4.40 0.00 1.81 1.66 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.31 1.02 7.81 28 Q 8.42 4.59 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.54 6.76 0.00 0.00 0.00 0.00 0.00 2.27 2.36 0.00 29 L 8.43 5.08 0.00 1.70 1.57 0.96 1.31 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 30 P 0.00 4.99 0.00 2.09 2.07 0.00 3.70 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 1.91 1.99 0.00 31 Y 8.91 4.73 0.00 2.85 2.89 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 32 L 8.59 5.06 0.00 1.67 1.61 0.93 0.76 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 A 9.15 5.13 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 34 Q 9.42 5.20 0.00 2.34 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.69 0.00 0.00 0.00 0.00 0.00 2.39 2.66 0.00 35 A 9.32 5.60 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 36 W 7.65 5.01 0.00 3.33 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 37 I 8.57 5.17 1.96 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.81 0.98 0.00 0.00 38 E 9.05 5.38 0.00 2.08 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 2.55 2.56 0.00 39 N 9.09 5.07 0.00 2.88 3.07 0.00 0.00 6.89 7.30 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 40 E 8.56 4.01 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 2.26 2.37 0.00 41 N 8.86 4.79 0.00 2.88 2.86 0.00 0.00 6.83 8.48 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 42 Q 8.02 3.40 0.00 2.09 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.32 6.62 0.00 0.00 0.00 0.00 0.00 1.25 1.86 0.00 43 E 7.67 4.65 0.00 2.07 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 2.26 2.41 0.00 44 K 8.59 4.76 0.00 1.71 1.73 0.00 1.49 0.00 0.00 1.24 0.00 0.00 2.70 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.52 1.46 7.81 45 I 8.31 4.77 2.07 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.75 1.02 0.00 0.00 46 I 8.33 4.46 1.87 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 1.47 0.84 0.91 0.00 0.00 47 T 9.23 4.25 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 48 G 7.64 4.09 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 0.00 0.00 0.00 49 P 0.00 4.99 0.00 1.94 2.22 0.00 3.93 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 1.95 1.86 0.00 50 V 7.34 4.67 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 0.51 0.00 0.00 -0.13 0.00 0.00 51 I 9.26 4.78 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 1.40 0.81 0.89 0.00 0.00 52 A 8.68 5.48 1.43 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 0.00 0.00 0.00 53 T 9.05 4.82 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 54 P 0.00 4.92 0.00 2.31 2.12 0.00 3.83 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 2.02 2.03 0.00 55 P 0.00 4.71 0.00 2.14 2.20 0.00 3.90 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 2.14 1.98 0.00 56 V 7.61 5.18 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 0.82 0.00 0.00 0.97 0.00 0.00 57 Q 8.77 4.71 0.00 2.19 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.69 0.00 0.00 0.00 0.00 0.00 2.45 2.36 0.00 58 R 8.58 4.66 0.00 1.87 1.89 0.00 3.19 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.68 0.00 59 L 8.78 4.80 0.00 1.83 1.59 0.97 1.21 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 60 E 8.85 4.60 0.00 1.92 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.27 0.00 61 P 0.00 4.55 0.00 2.28 2.24 0.00 3.89 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 2.02 2.01 0.00 62 G 8.80 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 63 A 8.12 4.28 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 64 K 8.43 4.83 0.00 1.61 1.69 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.85 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.32 1.39 7.81 65 S 8.44 4.54 0.00 3.90 3.68 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 66 M 8.29 4.93 0.00 2.11 2.06 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.50 0.00 67 V 8.76 4.61 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 1.05 0.00 0.00 1.10 0.00 0.00 68 R 9.38 5.00 0.00 1.89 1.78 0.00 3.13 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.75 0.00 69 L 9.20 5.37 0.00 1.76 1.69 0.85 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 70 S 9.10 5.40 0.00 3.89 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 71 T 8.16 5.00 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 0.69 0.00 0.00 72 T 8.14 4.42 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 73 P 0.00 4.27 0.00 2.19 2.14 0.00 3.59 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 2.11 2.11 0.00 74 D 8.06 4.51 0.00 2.67 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 75 I 7.69 3.50 1.74 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.82 0.95 0.00 0.00 76 S 7.75 4.28 0.00 4.08 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 77 K 7.82 4.13 0.00 1.96 1.91 0.00 1.58 0.00 0.00 1.69 0.00 0.00 3.06 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.45 7.81 78 L 7.54 4.29 0.00 1.73 1.66 0.72 0.93 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 79 P 0.00 4.38 0.00 2.06 1.99 0.00 3.70 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 2.04 2.12 0.00 80 Q 8.64 4.59 0.00 2.03 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.24 0.00 0.00 0.00 0.00 0.00 2.32 2.30 0.00 81 D 7.65 4.86 0.00 2.66 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 82 R 7.18 4.33 0.00 1.70 1.72 0.00 2.93 0.00 0.00 3.18 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.57 0.00 83 E 8.49 4.64 0.00 2.13 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 2.38 2.32 0.00 84 S 9.09 5.02 0.00 4.06 3.65 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 85 L 8.42 4.51 0.00 0.69 1.31 0.10 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 86 F 8.73 5.02 0.00 3.05 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 87 Y 9.20 5.00 0.00 2.91 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 88 F 9.19 5.10 0.00 3.09 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 89 N 7.22 4.80 0.00 1.44 1.42 0.00 0.00 6.16 6.03 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 90 L 8.30 4.69 0.00 1.52 1.40 0.98 0.74 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 91 R 9.02 5.19 0.00 2.05 2.06 0.00 3.25 0.00 0.00 3.66 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.78 0.00 92 E 8.81 4.98 0.00 2.25 2.01 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 2.63 2.44 0.00 93 I 8.69 4.60 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 1.33 0.88 0.90 0.00 0.00 94 P 0.00 3.92 0.00 1.95 2.21 0.00 3.80 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.01 0.00 95 P 0.00 4.17 0.00 1.95 2.02 0.00 2.48 0.00 0.00 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.67 0.00 96 R 8.53 3.97 0.00 1.78 1.90 0.00 3.17 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.58 0.00 97 S 8.41 4.72 0.00 3.95 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 E 8.37 4.64 0.00 1.95 1.97 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 2.21 2.28 0.00 99 K 7.46 4.12 0.00 1.73 1.74 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.47 1.38 7.81 100 A 8.38 4.15 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 0.00 101 N 8.55 4.14 0.00 2.81 2.82 0.00 0.00 6.75 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 0.00 102 V 7.22 4.56 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 0.80 0.00 0.00 1.00 0.00 0.00 103 L 8.32 4.74 0.00 1.54 1.51 0.93 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 104 Q 8.60 4.65 0.00 2.01 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.49 0.00 0.00 0.00 0.00 0.00 2.24 2.36 0.00 105 I 8.35 4.29 1.91 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 1.37 1.02 0.94 0.00 0.00 106 A 8.36 4.68 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 9.11 4.25 0.00 1.79 1.68 0.92 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 108 Q 8.57 4.95 0.00 2.10 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.49 0.00 0.00 0.00 0.00 0.00 2.10 2.29 0.00 109 T 8.97 4.57 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 1.23 0.00 0.00 110 K 8.68 4.93 0.00 1.68 1.61 0.00 1.52 0.00 0.00 1.29 0.00 0.00 3.16 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.37 1.41 7.81 111 I 8.58 4.80 1.97 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 1.42 0.96 1.05 0.00 0.00 112 K 8.38 3.76 0.00 1.18 0.74 0.00 1.73 0.00 0.00 1.89 0.00 0.00 2.95 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.18 1.38 7.81 113 L 8.31 4.74 0.00 1.65 1.53 1.05 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 114 F 8.88 5.08 0.00 3.15 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 0.00 115 Y 9.39 4.79 0.00 3.31 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 0.00 116 R 8.54 4.40 0.00 1.93 1.74 0.00 3.15 0.00 0.00 3.24 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.54 0.00 117 P 0.00 4.30 0.00 2.34 2.25 0.00 3.64 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.26 0.00 118 A 8.77 3.91 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.09 4.03 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.26 4.46 1.58 0.00 0.00 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 1.13 0.68 0.70 0.00 0.00 121 K 7.91 3.99 0.00 1.82 1.76 0.00 1.85 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.46 1.38 7.81 122 T 8.11 4.86 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 123 R 8.69 4.43 0.00 1.95 1.91 0.00 3.16 0.00 0.00 3.19 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 124 P 0.00 4.57 0.00 2.05 2.05 0.00 3.78 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 2.05 2.18 0.00 125 N 9.59 4.60 0.00 2.89 3.00 0.00 0.00 7.00 7.39 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 0.00 126 E 8.11 4.01 0.00 2.16 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 2.59 2.37 0.00 127 V 8.28 3.84 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 0.80 0.00 0.00 0.92 0.00 0.00 128 W 7.07 4.71 0.00 3.50 3.36 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 0.00 129 Q 6.90 3.81 0.00 0.93 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 7.12 0.00 0.00 0.00 0.00 0.00 1.16 1.77 0.00 130 D 7.78 4.58 0.00 2.63 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 0.00 131 Q 7.69 4.42 0.00 2.23 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.62 6.94 0.00 0.00 0.00 0.00 0.00 2.34 2.46 0.00 132 L 7.52 4.58 0.00 1.78 1.72 0.94 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 133 I 8.48 4.98 2.06 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.79 1.08 0.00 0.00 134 L 8.99 4.92 0.00 1.45 1.33 -0.14 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 135 N 8.84 5.46 0.00 2.85 2.75 0.00 0.00 6.28 8.30 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 0.00 136 K 9.31 4.04 0.00 1.81 1.61 0.00 1.59 0.00 0.00 1.44 0.00 0.00 2.18 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.89 1.39 7.81 137 V 8.38 4.34 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 0.74 0.00 0.00 0.96 0.00 0.00 138 S 8.41 4.22 0.00 3.83 3.80 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 0.00 139 G 9.60 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 0.00 0.00 0.00 0.00 140 G 6.44 4.47 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 0.00 141 Y 8.98 5.17 0.00 2.95 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 0.00 142 R 9.02 4.77 0.00 1.90 1.86 0.00 3.32 0.00 0.00 3.19 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 143 I 9.02 4.69 1.93 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 1.20 0.53 0.92 0.00 0.00 144 E 9.27 4.91 0.00 1.92 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 2.42 2.26 0.00 145 N 9.53 4.91 0.00 2.79 2.68 0.00 0.00 6.58 7.90 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 0.00 146 P 0.00 4.53 0.00 2.22 2.15 0.00 3.86 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 2.00 1.97 0.00 147 T 7.78 4.23 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 1.41 0.00 0.00 148 P 0.00 4.46 0.00 1.56 2.02 0.00 3.48 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 1.53 0.00 149 Y 6.89 5.00 0.00 2.45 2.64 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 0.00 150 Y 9.00 4.35 0.00 2.49 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 V 8.88 4.46 2.16 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 0.80 0.00 0.00 1.14 0.00 0.00 152 T 8.72 5.04 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 1.36 0.00 0.00 153 V 9.04 4.73 2.30 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 0.92 0.00 0.00 1.01 0.00 0.00 154 I 8.72 4.74 1.95 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 1.26 0.81 1.01 0.00 0.00 155 G 7.22 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 L 7.77 4.46 0.00 0.95 1.08 0.59 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 157 G 8.30 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 0.00 0.00 0.00 158 G 8.16 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 0.00 159 S 7.13 3.86 0.00 3.69 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 0.00 160 E 7.28 3.52 0.00 1.63 1.65 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 2.25 2.28 0.00 161 K 7.72 3.82 0.00 1.75 1.68 0.00 1.72 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.44 7.81 162 Q 7.84 3.85 0.00 2.07 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 163 A 7.96 3.91 1.35 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 0.00 0.00 164 E 8.04 3.95 0.00 1.91 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 2.47 0.00 165 E 8.18 4.53 0.00 2.01 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 2.22 2.18 0.00 166 G 8.04 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 0.00 167 E 8.61 4.17 0.00 1.99 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 2.34 2.34 0.00 168 F 8.41 4.70 0.00 2.96 3.04 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 0.00 169 E 7.90 4.06 0.00 1.77 1.53 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 2.19 2.27 0.00 170 T 8.47 4.53 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 171 V 9.05 4.66 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 1.09 0.00 0.00 1.01 0.00 0.00 172 M 8.82 5.27 0.00 2.20 2.14 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.88 0.00 173 L 9.17 4.72 0.00 1.69 1.60 1.00 0.84 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 0.00 174 S 8.68 4.24 0.00 3.68 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 0.00 175 P 0.00 4.18 0.00 1.66 1.70 0.00 3.13 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 1.68 1.40 0.00 176 R 8.13 3.69 0.00 1.75 1.85 0.00 3.10 0.00 0.00 3.16 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.53 0.00 177 S 8.04 4.81 0.00 3.84 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 0.00 178 E 8.45 5.22 0.00 2.07 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.32 0.00 179 Q 9.21 4.66 0.00 2.14 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.82 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 180 T 8.51 5.15 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 1.30 0.00 0.00 181 V 9.39 4.50 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 1.07 0.00 0.00 1.05 0.00 0.00 182 K 8.73 4.57 0.00 1.58 1.59 0.00 1.90 0.00 0.00 1.63 0.00 0.00 2.75 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.36 1.01 7.81 183 S 9.50 4.79 0.00 4.11 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 0.00 184 A 8.60 4.36 0.98 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 0.00 185 N 8.03 4.47 0.00 2.53 2.59 0.00 0.00 6.79 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 0.00 186 Y 8.59 4.91 0.00 3.08 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 0.00 187 N 9.42 4.49 0.00 2.77 2.97 0.00 0.00 6.94 7.70 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 0.00 188 T 7.57 4.72 4.19 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 0.00 0.00 0.00 1.26 0.00 0.00 189 P 0.00 4.67 0.00 1.81 2.20 0.00 3.70 0.00 0.00 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.93 0.00 190 Y 9.02 5.10 0.00 2.90 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 0.00 191 L 9.18 5.11 0.00 1.36 1.58 0.68 0.90 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 0.00 192 S 8.62 5.33 0.00 3.84 3.55 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 0.00 193 Y 8.02 5.36 0.00 3.19 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 0.00 194 I 8.34 4.96 1.98 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.69 1.02 0.00 0.00 195 N 8.69 4.81 0.00 2.90 3.06 0.00 0.00 6.55 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 0.00 196 D 8.31 4.30 0.00 1.58 2.37 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 0.00 197 Y 7.61 4.43 0.00 3.07 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.56 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 G 8.64 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 0.00 200 R 7.67 5.64 0.00 1.67 1.73 0.00 3.25 0.00 0.00 3.88 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.52 0.00 201 P 0.00 4.35 0.00 1.43 1.78 0.00 2.64 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.87 0.00 202 V 8.10 4.76 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 0.93 0.00 0.00 0.90 0.00 0.00 203 L 9.56 4.81 0.00 1.89 1.50 1.02 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 204 S 8.44 4.32 0.00 3.78 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 F 8.51 5.03 0.00 2.98 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 0.00 206 I 8.76 4.66 1.84 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.11 0.92 0.00 0.00 207 C 8.91 5.40 0.00 2.91 3.06 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 0.00 208 N 8.97 4.76 0.00 2.67 2.66 0.00 0.00 7.44 8.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 G 8.26 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 0.00 210 S 8.76 4.54 0.00 3.90 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 0.00 211 R 7.75 5.01 0.00 1.89 1.82 0.00 3.07 0.00 0.00 3.20 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 212 C 9.78 5.72 0.00 2.91 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 S 9.03 5.27 0.00 3.82 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 0.00 214 V 7.83 3.18 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 0.48 0.00 0.00 -0.03 0.00 0.00 215 K 8.65 3.65 0.00 1.54 1.68 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.44 7.81 216 K 8.85 3.87 0.00 1.78 1.72 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.36 1.00 7.81 *217 E 8.01 4.22 0.00 1.73 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.37 0.00 * Residues marked with a * may have inaccurate shift predictions.