NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 I 3.9994 8.0244 120.8052 60.4213 39.1378 175.1362 6 S 4.2146 8.4125 121.4384 56.5599 62.5206 172.4387 7 D 4.9465 8.8797 123.1247 54.6848 40.6592 174.8176 8 N 5.3531 8.4984 119.9434 52.8478 41.7568 173.6625 9 V 4.7133 9.1355 119.1679 59.7437 36.3918 174.9320 10 R 4.9698 8.6617 120.6899 55.0072 32.9450 175.6665 11 I 4.8813 8.5365 120.8722 59.4400 41.6229 174.4799 12 K 4.7889 8.7977 126.6455 54.4710 35.3321 174.4791 13 L 5.3142 8.7728 129.1048 53.5768 45.3984 174.6052 14 Y 5.1425 8.9457 121.8926 56.1030 42.9960 173.7689 *16 E 4.2362 8.5634 120.2329 56.5262 31.4334 174.6072 17 G 3.9749 7.3225 111.3675 46.2536 0.0000 172.0158 18 T 5.3816 8.4490 115.7691 61.9013 72.7299 173.6975 19 V 4.7775 8.9692 126.2315 61.4945 34.5149 175.3352 20 N 4.2443 9.7245 126.2502 54.6175 36.6209 174.4593 21 N 4.3015 8.5313 111.2925 54.1511 38.0148 172.2361 22 H 4.8376 8.4052 117.5901 54.5450 30.9841 173.1234 23 H 5.1227 8.6261 127.1120 56.1733 31.0262 174.3903 24 F 5.2656 7.5840 118.1347 57.4411 40.9984 172.4980 *26 C 4.9645 8.5831 115.0730 60.7470 29.4975 173.2701 27 E 4.9920 8.9646 118.4971 55.2494 33.9862 174.3358 28 A 5.2566 8.7718 123.4852 49.6785 23.5843 174.6671 29 E 4.9201 8.6095 118.0160 54.9596 33.4044 175.8121 30 G 4.5367 8.7497 109.7849 46.5649 0.0000 171.2024 31 E 5.1948 8.6095 115.8424 55.9840 32.9738 174.1044 32 G 3.9934 8.8076 106.4897 45.7759 0.0000 172.6317 33 K 4.8995 8.8956 120.2648 52.6616 33.1951 175.4332 34 P 4.1569 0.0000 0.0000 65.8260 31.3940 178.5336 35 Y 4.3830 7.8477 112.2290 59.6681 38.1634 176.2629 36 E 4.2383 8.2638 118.5812 56.4191 30.3622 177.4520 37 G 3.9248 8.0189 105.5091 45.9032 0.0000 172.4817 38 T 5.2143 7.5568 115.6050 61.9279 71.9930 173.6098 39 Q 4.7994 8.3185 120.8930 55.8437 32.4657 172.6728 *41 E 4.3886 8.6285 116.6830 56.8520 31.4082 175.3122 42 N 5.2680 8.8497 121.0588 51.8577 39.8624 172.8733 43 I 4.4713 8.8188 125.3145 60.0901 39.1085 174.6376 44 K 4.9819 9.0314 128.9414 54.5249 34.7265 175.1523 45 V 4.4845 8.9122 128.8727 62.5908 30.9651 175.7529 46 T 4.2973 8.7306 118.8228 62.7699 69.7867 174.9902 47 K 4.4607 7.8784 122.9460 56.3176 35.1338 176.0766 48 G 4.1350 9.2803 113.5029 45.6132 0.0000 172.9389 49 G 4.1883 7.5690 106.9159 42.2551 0.0000 171.9674 50 P 4.3105 0.0000 0.0000 62.1536 31.8541 176.8241 51 L 3.7377 8.1540 122.2527 54.0196 41.9771 176.0873 52 P 4.4732 0.0000 0.0000 63.2766 31.1340 175.4035 53 F 4.9890 6.6014 112.9054 54.9450 41.3684 174.0826 54 S 4.1757 8.8333 116.2266 58.5392 62.5877 175.0759 55 F 4.1884 8.8426 129.0158 60.4903 39.9240 176.4889 56 D 4.5628 8.1129 120.8362 57.6563 40.3012 178.4791 57 I 4.4111 7.3438 110.4763 63.1037 37.7839 177.4770 58 L 4.2252 7.7130 121.1994 56.9742 41.7566 178.5311 59 T 4.0360 7.0895 115.0270 66.3988 68.3452 174.2885 60 P 4.2183 0.0000 0.0000 65.0271 31.2070 177.0578 61 N 4.9971 8.2821 115.6712 54.4151 40.1290 175.5744 62 C 4.4464 7.7859 120.0450 58.4805 27.3672 174.0434 *66 S 4.1441 7.5904 122.2487 58.4324 63.9807 175.9675 67 V 3.2724 7.3544 111.5940 62.6606 31.7176 177.7290 68 A 4.3747 7.9800 121.8631 53.5496 19.0046 177.7478 69 I 4.4245 7.2097 117.2507 59.5930 36.3219 174.4234 70 T 4.8698 7.6458 119.6040 62.2742 73.1058 173.1855 71 K 4.3140 8.7916 127.9705 56.4040 32.8974 175.5593 72 Y 4.3510 8.7245 126.9835 57.5098 38.5750 175.4756 73 T 4.3726 8.4122 116.3005 60.2027 72.2116 175.0054 74 S 3.6820 9.5883 114.3353 59.5310 60.4053 173.4502 75 G 3.9576 8.4873 104.8897 46.0192 0.0000 174.4086 76 I 3.8148 7.7713 121.4491 60.0028 37.2333 174.3447 77 P 4.0180 0.0000 0.0000 63.7199 31.3089 176.4425 78 D 3.3700 8.1397 121.7262 52.3420 40.3576 175.5690 79 Y 3.7572 7.7015 126.8367 60.2404 38.9321 177.5582 80 F 3.5652 7.2310 117.8783 60.2812 39.1270 177.9330 81 K 4.3315 8.2065 117.9721 59.4751 31.5595 179.5186 82 Q 3.9565 7.7434 117.7821 58.8662 28.7499 178.6296 83 S 3.9961 7.3699 115.6324 60.0902 62.7627 174.6814 84 F 4.9401 6.7559 120.1145 56.3918 39.3100 174.0642 85 P 4.6723 0.0000 0.0000 64.9349 31.8161 177.4266 86 E 3.9627 8.3243 118.7635 58.4689 29.8073 177.0202 87 G 3.7584 9.7439 104.6037 44.9664 0.0000 171.0511 88 F 5.1591 7.5267 112.2938 56.7389 41.8127 172.6562 89 T 5.3465 9.1248 108.6217 60.3094 72.6393 172.6404 90 W 5.8512 8.9010 118.0695 55.2593 32.0910 173.4043 91 E 5.2360 9.2116 118.8804 55.0561 32.5922 174.4536 92 R 5.1881 8.9924 120.4549 55.8381 34.6095 173.5013 93 T 5.1214 8.5858 119.7876 62.1338 72.4909 172.8548 94 T 4.8972 9.3406 123.3051 61.8887 71.1620 173.3960 95 I 4.2199 8.6375 128.1127 59.7127 39.1238 174.7172 96 Y 4.6663 8.6174 126.2249 56.7219 38.9347 177.1419 97 E 4.0395 9.1003 121.1573 58.6299 29.7918 177.2930 98 D 4.7211 8.1453 118.3718 53.1521 39.7442 177.3325 99 G 3.8642 7.9820 106.9685 45.7841 0.0000 174.0174 100 A 4.3085 7.2193 121.5339 51.1935 20.3864 176.1373 101 Y 5.1324 8.6961 117.9336 56.0968 42.2996 174.6113 102 L 5.3254 9.1350 124.5683 53.9733 45.6844 174.9001 103 T 5.2350 9.2099 123.4029 62.2239 71.4140 173.6639 104 T 5.1639 9.4708 121.8738 61.8054 73.1268 172.6967 105 Q 4.6297 8.7466 125.2023 54.3481 32.2346 173.7409 106 Q 4.7578 8.5609 126.9518 54.1562 32.9174 173.2896 107 E 4.8980 9.0188 124.4713 54.7666 33.2667 174.9863 108 T 5.1162 8.8644 120.2761 61.6395 71.9101 173.0213 109 K 4.8397 9.0790 126.4552 54.6052 36.3475 174.8531 110 L 4.6587 8.7225 128.1003 53.6579 42.7894 175.2077 111 D 4.5820 9.1867 127.9851 52.8455 41.4873 179.3506 112 G 3.8183 8.9400 118.8492 46.0149 0.0000 171.5447 113 N 4.9027 9.2635 118.4358 52.3036 39.7059 174.0929 114 C 5.1202 7.9051 120.9151 57.8101 34.1560 172.8747 115 L 4.6058 8.7086 127.3056 54.3719 42.9635 176.0371 116 V 4.6801 9.1710 123.6271 61.3497 34.2766 173.5323 117 Y 5.5473 8.9313 126.2106 56.5435 40.3259 174.3719 118 N 5.4720 9.2537 121.9006 51.5826 41.4424 173.5811 119 I 4.8786 8.8671 124.9768 59.2658 40.4585 175.2225 120 K 4.8481 8.9910 125.9911 54.6770 35.2468 175.3259 121 I 5.2535 8.6173 124.0909 59.6522 41.9474 174.4861 122 L 5.1147 8.9751 124.8064 53.2567 45.7171 175.6252 123 G 4.8356 9.6427 111.7241 44.6886 0.0000 171.2539 124 C 5.1449 9.4476 116.9390 57.2721 33.6325 173.9293 125 N 4.4991 9.0471 114.9244 54.0954 35.6512 174.4380 126 F 3.9587 8.5657 118.3275 56.3586 39.3458 173.7323 127 P 4.3775 0.0000 0.0000 62.1250 31.5015 175.6451 128 P 4.2516 0.0000 0.0000 65.3777 31.3228 176.6796 129 N 4.7449 8.0749 113.7095 52.7173 39.2712 174.9424 130 G 3.9638 7.9651 109.6392 43.8988 0.0000 173.4408 131 P 4.0656 0.0000 0.0000 65.7622 31.4187 178.7878 132 V 3.6897 7.2583 113.3069 63.9687 30.6472 177.0098 *134 Q 4.2272 7.9266 115.8478 54.1178 30.4798 174.8332 135 K 3.8738 7.9192 115.7545 58.1085 29.7122 175.4750 136 K 4.8421 8.4658 113.7336 56.5126 32.1702 176.9738 137 T 4.9173 7.8379 108.5389 59.4220 72.0322 174.5997 138 Q 4.5611 8.5046 121.2862 55.5782 29.1575 177.0537 139 G 4.0679 8.4936 102.6280 45.4725 0.0000 173.6455 140 W 4.6689 8.2646 119.0587 56.0169 30.0628 176.0566 141 E 4.6320 8.6075 122.8063 54.6599 30.2589 174.2373 142 P 4.7606 0.0000 0.0000 63.3520 32.4149 174.4012 143 C 4.8867 9.0391 114.6589 56.9811 33.9336 172.1449 144 C 5.0167 8.5100 118.6972 57.9378 33.0098 172.5125 145 E 4.7047 9.1353 131.2805 55.3942 32.5653 174.1700 *147 R 4.2598 8.4192 115.1769 56.4868 31.9635 174.3031 148 Y 5.1008 7.7327 119.6084 56.0677 41.5934 173.9991 149 T 4.6739 8.4769 111.3947 61.4983 70.8509 174.0941 150 R 4.3479 9.0199 119.6611 57.0790 33.6286 174.5212 151 D 4.4735 9.9457 124.3212 55.4947 38.4167 174.8524 152 G 3.9285 8.5901 105.2266 45.5418 0.0000 173.5312 153 V 4.5098 7.6476 112.4033 59.2516 36.3036 173.6691 154 L 4.5279 7.5771 121.9159 53.7470 43.6736 175.3347 155 C 4.8812 8.8177 124.0665 58.3251 31.1961 172.9500 156 G 4.5556 8.4785 106.7950 44.9549 0.0000 171.9236 157 Q 5.2134 8.5784 120.7828 54.4181 32.7580 174.6241 158 T 4.7726 9.1134 118.9459 61.9747 73.3388 172.9307 159 L 5.1972 8.6170 122.7564 51.8665 45.7313 175.7260 *161 A 4.3486 8.2493 120.2979 52.0001 20.1835 175.4503 162 L 4.0554 8.8612 125.9466 54.0297 43.5909 176.2896 163 K 4.1618 8.5427 126.6620 57.0869 33.2870 176.1542 164 C 4.6337 9.3109 122.9357 58.8863 31.1997 174.4254 165 A 3.5104 8.2412 116.6352 55.9456 17.7238 179.7924 166 D 4.5036 8.5737 119.2273 52.9779 40.2291 177.1613 167 G 3.8368 7.8919 102.0465 46.5357 0.0000 172.8116 168 N 4.9300 7.3808 117.1663 51.9711 41.5779 173.4305 169 H 5.2570 8.4193 115.3870 54.4520 32.7828 173.0470 170 L 4.7577 9.2128 126.2921 53.9594 43.3926 175.3855 171 T 5.0231 9.6544 117.8160 60.8887 70.8281 173.4559 172 C 5.0872 8.3275 116.5234 57.1624 34.0237 171.7674 173 H 5.3058 8.9569 119.0292 54.4539 32.3901 171.8674 174 L 5.0435 9.3614 126.5858 53.2110 44.1907 175.7660 175 R 4.8674 8.6122 121.8091 54.8377 33.1940 174.6613 176 T 4.9507 9.3299 120.9365 61.8038 72.9193 173.3410 177 T 4.5939 8.4036 120.3092 62.0071 71.5032 172.4251 178 Y 5.1799 8.9892 124.8309 56.4419 40.6885 175.0939 179 R 4.7680 9.5318 123.2203 54.2466 32.7971 175.2408 180 S 4.5032 9.1825 119.8508 58.2963 62.7885 174.2835 181 K 4.3724 8.5811 123.5772 57.0369 32.3939 177.5649 182 K 4.1796 7.9352 119.7578 55.5310 33.1277 176.4996 183 A 4.3699 8.1448 123.1830 51.0249 20.0891 178.3668 184 A 4.0265 8.7191 122.6795 55.5075 18.3981 180.5997 185 K 4.0119 8.0891 113.0045 58.6815 32.2340 177.5150 186 A 4.5786 7.9661 119.8855 51.5407 19.2980 176.3200 187 L 4.6979 7.6937 118.2577 53.8335 44.5621 176.7515 188 Q 4.6091 8.5689 120.3529 52.4388 31.0277 173.3891 *190 P 4.2485 0.0000 0.0000 63.4556 32.1009 174.7072 191 P 4.6394 0.0000 0.0000 61.8737 32.5727 175.2689 192 F 4.4476 8.6846 120.9612 59.2613 39.6528 173.8225 193 H 4.6477 7.5496 120.1454 55.0529 31.8813 171.9797 194 F 5.0880 9.2181 116.6551 55.7383 43.2117 174.9033 195 S 4.8844 8.9162 114.3255 56.9499 65.3786 172.7631 196 D 5.1139 9.1561 128.0696 54.2385 42.4487 175.1650 197 H 5.2899 9.2086 121.1246 54.8148 33.9764 172.1875 198 R 4.7561 9.1298 125.4128 53.7057 31.0334 170.9708 199 P 5.1237 0.0000 0.0000 62.1995 32.8650 175.8226 200 E 4.8328 9.5346 122.2310 55.0818 34.5085 174.1158 201 I 4.8955 8.5994 124.8245 60.3358 38.0657 175.8735 202 V 4.2258 8.5399 120.5241 61.5015 32.5890 176.3586 203 K 4.4634 7.5606 120.2847 55.3194 35.5416 173.9223 204 V 4.6072 8.3240 126.4773 61.1466 34.4199 174.3498 205 S 4.3110 8.5130 121.3077 56.9322 67.1571 172.8589 206 E 3.8955 9.0163 115.2632 58.0861 26.3927 174.3619 207 N 3.8541 8.4775 108.6853 54.8107 37.8638 173.1970 208 G 3.7237 8.0193 99.2175 47.1324 0.0000 174.4591 209 T 4.6577 7.2785 106.3263 60.2793 71.4508 173.2475 210 L 5.1086 7.6251 125.3431 53.2044 44.8903 174.8655 211 F 5.1052 9.3723 125.1553 55.5506 42.5032 173.8845 212 E 4.7446 9.4575 126.0149 55.4545 30.3192 174.4470 213 Q 5.3710 9.3441 129.1803 54.8192 31.3408 174.2571 214 H 5.4496 9.5511 122.0064 54.4556 33.8276 172.0214 215 E 5.9151 8.5357 115.1615 56.6600 33.1463 174.3592 216 S 5.3872 8.6673 117.2229 57.0133 67.2517 173.0417 217 S 5.0988 8.8015 116.9598 57.1087 66.9336 173.1624 218 V 4.7861 8.5732 120.8574 61.5387 35.1900 173.2460 219 A 4.8474 8.5937 130.6191 50.7437 20.6881 176.2847 220 R 4.3645 8.7628 118.2371 56.1091 33.4296 173.0694 221 Y 5.2490 8.2901 116.8247 56.3098 40.9475 175.4165 222 C 4.2439 9.2032 120.8201 59.5977 31.0612 172.7338 223 Q 4.5406 8.5554 125.2319 56.4739 29.4436 176.7096 224 T 4.0791 7.8755 108.3789 63.1897 69.5212 174.2885 225 C 4.6565 7.7656 119.6167 56.8684 29.5022 171.8617 226 P 4.3037 0.0000 0.0000 62.6688 31.5248 175.8188 227 S 4.6292 8.3661 115.4150 56.5525 63.5882 173.5250 228 K 4.4659 8.4959 130.8342 56.7546 32.3214 177.3441 229 L 4.5120 8.0935 115.7534 54.6461 45.7925 177.5002 230 G 4.0103 7.7493 103.9633 45.4681 0.0000 173.4557 231 H 4.5222 7.7505 116.7355 55.0283 29.7102 175.0611 232 N 4.3476 8.3778 116.9776 53.1619 37.3621 175.0778 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 5 I 8.02 4.00 1.68 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.11 0.89 0.00 0.00 6 S 8.41 4.21 0.00 3.97 3.75 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 7 D 8.88 4.95 0.00 3.00 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 8 N 8.50 5.35 0.00 2.72 2.71 0.00 0.00 6.91 7.95 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 9 V 9.14 4.71 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 0.61 0.00 0.00 0.89 0.00 0.00 10 R 8.66 4.97 0.00 1.69 1.77 0.00 3.04 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.55 0.00 11 I 8.54 4.88 1.67 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 0.91 0.64 0.54 0.00 0.00 12 K 8.80 4.79 0.00 1.68 1.60 0.00 1.00 0.00 0.00 1.47 0.00 0.00 2.96 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.37 1.50 7.81 13 L 8.77 5.31 0.00 1.74 1.42 1.18 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.95 5.14 0.00 2.97 2.81 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 *16 E 8.56 4.24 0.00 2.05 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.24 0.00 17 G 7.32 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 T 8.45 5.38 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 1.32 0.00 0.00 19 V 8.97 4.78 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 0.30 0.00 0.00 0.94 0.00 0.00 20 N 9.72 4.24 0.00 2.89 2.92 0.00 0.00 7.06 7.44 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 21 N 8.53 4.30 0.00 2.92 3.00 0.00 0.00 7.03 7.89 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 22 H 8.41 4.84 0.00 3.32 3.55 0.00 5.63 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 H 8.63 5.12 0.00 3.09 3.18 0.00 6.02 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 F 7.58 5.27 0.00 3.34 3.24 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 *26 C 8.58 4.96 0.00 3.10 3.19 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 0.00 27 E 8.96 4.99 0.00 1.85 1.63 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 2.08 2.30 0.00 28 A 8.77 5.26 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 29 E 8.61 4.92 0.00 1.82 1.77 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 2.20 2.17 0.00 30 G 8.75 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 31 E 8.61 5.19 0.00 2.10 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 2.26 2.31 0.00 32 G 8.81 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 0.00 0.00 0.00 33 K 8.90 4.90 0.00 1.70 1.80 0.00 1.75 0.00 0.00 1.79 0.00 0.00 2.89 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.25 7.81 34 P 0.00 4.16 0.00 1.71 1.90 0.00 3.75 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 2.10 0.00 35 Y 7.85 4.38 0.00 3.01 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 E 8.26 4.24 0.00 2.14 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 0.00 2.40 2.45 0.00 37 G 8.02 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 0.00 0.00 0.00 38 T 7.56 5.21 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 1.26 0.00 0.00 39 Q 8.32 4.80 0.00 2.16 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.56 0.00 0.00 0.00 0.00 0.00 2.31 2.23 0.00 *41 E 8.63 4.39 0.00 2.06 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 2.32 2.42 0.00 42 N 8.85 5.27 0.00 2.79 2.75 0.00 0.00 6.96 6.95 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 43 I 8.82 4.47 2.04 0.00 0.00 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 1.27 0.70 1.18 0.00 0.00 44 K 9.03 4.98 0.00 1.84 1.78 0.00 1.71 0.00 0.00 1.55 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.41 7.81 45 V 8.91 4.48 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 0.93 0.00 0.00 1.09 0.00 0.00 46 T 8.73 4.30 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 1.31 0.00 0.00 47 K 7.88 4.46 0.00 1.84 1.67 0.00 1.68 0.00 0.00 1.86 0.00 0.00 3.01 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.45 1.54 7.81 48 G 9.28 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 0.00 0.00 0.00 49 G 7.57 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 0.00 0.00 0.00 0.00 50 P 0.00 4.31 0.00 2.00 1.97 0.00 3.66 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.18 0.00 51 L 8.15 3.74 0.00 1.26 0.22 0.43 0.59 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 52 P 0.00 4.47 0.00 2.15 2.04 0.00 2.95 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.61 0.00 53 F 6.60 4.99 0.00 2.81 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 54 S 8.83 4.18 0.00 3.88 3.79 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 0.00 0.00 0.00 55 F 8.84 4.19 0.00 2.69 2.66 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 56 D 8.11 4.56 0.00 2.66 2.47 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 57 I 7.34 4.41 1.99 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.38 0.90 0.00 0.00 58 L 7.71 4.23 0.00 0.75 1.41 0.61 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 59 T 7.09 4.04 4.57 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 1.33 0.00 0.00 60 P 0.00 4.22 0.00 1.96 1.65 0.00 3.77 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 1.93 1.66 0.00 61 N 8.28 5.00 0.00 2.95 3.08 0.00 0.00 6.95 8.46 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 62 C 7.79 4.45 0.00 3.17 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 *66 S 7.59 4.14 0.00 3.94 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 V 7.35 3.27 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 -0.07 0.00 0.00 0.30 0.00 0.00 68 A 7.98 4.37 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 I 7.21 4.42 2.05 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 1.27 0.79 0.97 0.00 0.00 70 T 7.65 4.87 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 1.09 0.00 0.00 71 K 8.79 4.31 0.00 1.98 1.72 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.70 7.81 72 Y 8.72 4.35 0.00 2.92 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 73 T 8.41 4.37 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 1.20 0.00 0.00 74 S 9.59 3.68 0.00 3.96 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 75 G 8.49 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 76 I 7.77 3.81 1.98 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.42 0.76 0.00 0.00 77 P 0.00 4.02 0.00 2.25 2.07 0.00 3.79 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.99 0.00 78 D 8.14 3.37 0.00 2.34 2.36 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 79 Y 7.70 3.76 0.00 2.46 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 0.00 0.00 0.00 80 F 7.23 3.57 0.00 3.11 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 K 8.21 4.33 0.00 1.81 1.95 0.00 1.69 0.00 0.00 1.22 0.00 0.00 2.23 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.53 1.57 7.81 82 Q 7.74 3.96 0.00 1.95 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.00 0.00 0.00 0.00 0.00 0.00 2.32 2.46 0.00 83 S 7.37 4.00 0.00 3.68 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 84 F 6.76 4.94 0.00 3.08 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 85 P 0.00 4.67 0.00 2.24 2.25 0.00 3.84 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 2.04 2.03 0.00 86 E 8.32 3.96 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 87 G 9.74 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 88 F 7.53 5.16 0.00 3.39 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 89 T 9.12 5.35 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 90 W 8.90 5.85 0.00 3.36 3.46 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 91 E 9.21 5.24 0.00 2.03 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.22 0.00 92 R 8.99 5.19 0.00 2.01 2.15 0.00 3.16 0.00 0.00 3.12 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.71 0.00 93 T 8.59 5.12 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 1.37 0.00 0.00 94 T 9.34 4.90 4.36 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 0.91 0.00 0.00 95 I 8.64 4.22 1.74 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 1.28 0.62 0.53 0.00 0.00 96 Y 8.62 4.67 0.00 2.78 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 97 E 9.10 4.04 0.00 2.07 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 0.00 2.47 2.28 0.00 98 D 8.15 4.72 0.00 2.78 2.78 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 99 G 7.98 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 A 7.22 4.31 -0.22 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 0.00 101 Y 8.70 5.13 0.00 2.91 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 0.00 102 L 9.13 5.33 0.00 2.07 1.75 1.06 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 103 T 9.21 5.24 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 1.28 0.00 0.00 104 T 9.47 5.16 4.38 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 1.04 0.00 0.00 105 Q 8.75 4.63 0.00 2.04 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.76 0.00 0.00 0.00 0.00 0.00 2.16 2.18 0.00 106 Q 8.56 4.76 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.53 0.00 0.00 0.00 0.00 0.00 2.20 2.11 0.00 107 E 9.02 4.90 0.00 1.85 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 0.00 2.14 2.15 0.00 108 T 8.86 5.12 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 1.31 0.00 0.00 109 K 9.08 4.84 0.00 1.81 1.61 0.00 1.60 0.00 0.00 1.58 0.00 0.00 2.81 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.35 1.39 7.81 110 L 8.72 4.66 0.00 0.93 1.44 0.65 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 111 D 9.19 4.58 0.00 2.68 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 G 8.94 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 0.00 113 N 9.26 4.90 0.00 2.71 2.97 0.00 0.00 5.35 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 0.00 114 C 7.91 5.12 0.00 2.96 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 0.00 115 L 8.71 4.61 0.00 1.40 1.33 1.05 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 116 V 9.17 4.68 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 1.13 0.00 0.00 1.00 0.00 0.00 117 Y 8.93 5.55 0.00 2.98 2.79 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 0.00 0.00 0.00 118 N 9.25 5.47 0.00 2.68 2.67 0.00 0.00 6.38 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 I 8.87 4.88 1.91 0.00 0.00 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 1.12 0.65 0.86 0.00 0.00 120 K 8.99 4.85 0.00 1.56 1.61 0.00 1.55 0.00 0.00 1.59 0.00 0.00 2.81 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.28 1.31 7.81 121 I 8.62 5.25 1.93 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 1.29 0.70 1.06 0.00 0.00 122 L 8.98 5.11 0.00 1.59 1.55 0.92 0.83 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 0.00 123 G 9.64 4.84 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 0.00 0.00 0.00 124 C 9.45 5.14 0.00 2.99 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 0.00 125 N 9.05 4.50 0.00 3.08 3.01 0.00 0.00 6.98 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 0.00 126 F 8.57 3.96 0.00 3.06 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 0.00 127 P 0.00 4.38 0.00 2.23 2.20 0.00 3.66 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.07 0.00 128 P 0.00 4.25 0.00 2.22 2.27 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 2.01 2.02 0.00 129 N 8.07 4.74 0.00 2.74 2.88 0.00 0.00 6.88 7.65 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 0.00 130 G 7.97 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 0.00 131 P 0.00 4.07 0.00 2.19 2.30 0.00 3.71 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.95 0.00 132 V 7.26 3.69 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 0.68 0.00 0.00 0.88 0.00 0.00 *134 Q 7.93 4.23 0.00 2.22 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.33 6.70 0.00 0.00 0.00 0.00 0.00 2.49 2.34 0.00 135 K 7.92 3.87 0.00 1.90 1.89 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.35 1.44 7.81 136 K 8.47 4.84 0.00 1.60 1.72 0.00 1.59 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.33 1.51 7.81 137 T 7.84 4.92 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 1.17 0.00 0.00 138 Q 8.50 4.56 0.00 1.85 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 5.57 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 139 G 8.49 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 W 8.26 4.67 0.00 3.32 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 0.00 141 E 8.61 4.63 0.00 2.26 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 2.31 2.34 0.00 142 P 0.00 4.76 0.00 2.11 2.05 0.00 3.81 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 2.00 1.98 0.00 143 C 9.04 4.89 0.00 3.03 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 0.00 144 C 8.51 5.02 0.00 2.92 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 0.00 145 E 9.14 4.70 0.00 1.97 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.35 0.00 *147 R 8.42 4.26 0.00 1.17 1.52 0.00 3.08 0.00 0.00 3.37 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.43 0.00 148 Y 7.73 5.10 0.00 3.18 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 T 8.48 4.67 4.18 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 1.18 0.00 0.00 150 R 9.02 4.35 0.00 1.96 1.78 0.00 3.32 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.59 0.00 151 D 9.95 4.47 0.00 2.84 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 G 8.59 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 0.00 153 V 7.65 4.51 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 0.79 0.00 0.00 0.99 0.00 0.00 154 L 7.58 4.53 0.00 0.38 0.68 0.62 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 155 C 8.82 4.88 0.00 1.69 2.21 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 0.00 156 G 8.48 4.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 Q 8.58 5.21 0.00 2.05 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.71 0.00 0.00 0.00 0.00 0.00 2.34 2.56 0.00 158 T 9.11 4.77 4.16 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 1.15 0.00 0.00 159 L 8.62 5.20 0.00 1.44 1.54 0.73 0.85 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 *161 A 8.25 4.35 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 0.00 162 L 8.86 4.06 0.00 1.35 1.24 0.60 -0.23 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 0.00 163 K 8.54 4.16 0.00 1.76 1.62 0.00 1.81 0.00 0.00 1.90 0.00 0.00 2.78 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.49 7.81 164 C 9.31 4.63 0.00 2.87 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 A 8.24 3.51 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 0.00 166 D 8.57 4.50 0.00 2.67 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 0.00 167 G 7.89 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 0.00 0.00 0.00 168 N 7.38 4.93 0.00 2.73 2.77 0.00 0.00 6.77 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 0.00 169 H 8.42 5.26 0.00 2.98 3.16 0.00 5.68 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 L 9.21 4.76 0.00 1.73 1.55 0.99 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 171 T 9.65 5.02 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 1.24 0.00 0.00 172 C 8.33 5.09 0.00 2.37 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 0.00 0.00 0.00 0.00 173 H 8.96 5.31 0.00 3.16 3.06 0.00 5.76 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 L 9.36 5.04 0.00 1.55 1.45 0.76 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 175 R 8.61 4.87 0.00 1.70 1.76 0.00 2.87 0.00 0.00 3.10 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.31 0.00 176 T 9.33 4.95 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 0.43 0.00 0.00 177 T 8.40 4.59 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 1.19 0.00 0.00 178 Y 8.99 5.18 0.00 2.96 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 0.00 179 R 9.53 4.77 0.00 1.81 1.93 0.00 3.19 0.00 0.00 3.14 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 180 S 9.18 4.50 0.00 2.72 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 K 8.58 4.37 0.00 1.77 1.84 0.00 1.78 0.00 0.00 1.73 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.52 1.72 7.81 182 K 7.94 4.18 0.00 1.61 1.65 0.00 1.68 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.40 7.81 183 A 8.14 4.37 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 0.00 184 A 8.72 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 0.00 185 K 8.09 4.01 0.00 1.76 1.89 0.00 1.73 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 1.45 1.44 7.81 186 A 7.97 4.58 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 0.00 187 L 7.69 4.70 0.00 1.61 1.54 0.68 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 188 Q 8.57 4.61 0.00 2.04 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.48 0.00 0.00 0.00 0.00 0.00 2.21 2.13 0.00 *190 P 0.00 4.25 0.00 2.18 2.27 0.00 3.62 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.88 0.00 191 P 0.00 4.64 0.00 2.38 2.25 0.00 3.86 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 2.28 2.17 0.00 192 F 8.68 4.45 0.00 3.08 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 0.00 193 H 7.55 4.65 0.00 3.10 3.04 0.00 5.55 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 F 9.22 5.09 0.00 2.91 2.90 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 0.00 195 S 8.92 4.88 0.00 3.68 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 0.00 196 D 9.16 5.11 0.00 2.58 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 H 9.21 5.29 0.00 3.02 2.99 0.00 5.54 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 R 9.13 4.76 0.00 1.87 1.75 0.00 3.15 0.00 0.00 3.24 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.56 0.00 199 P 0.00 5.12 0.00 2.20 2.02 0.00 3.66 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.78 0.00 200 E 9.53 4.83 0.00 1.94 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 201 I 8.60 4.90 2.04 0.00 0.00 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 1.60 0.77 1.19 0.00 0.00 202 V 8.54 4.23 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 1.01 0.00 0.00 203 K 7.56 4.46 0.00 1.79 1.59 0.00 1.64 0.00 0.00 1.72 0.00 0.00 2.72 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.32 1.36 7.81 204 V 8.32 4.61 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 0.41 0.00 0.00 0.94 0.00 0.00 205 S 8.51 4.31 0.00 3.74 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 0.00 206 E 9.02 3.90 0.00 2.06 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 2.24 2.17 0.00 207 N 8.48 3.85 0.00 2.75 2.79 0.00 0.00 7.24 7.98 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 0.00 208 G 8.02 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 T 7.28 4.66 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 1.25 0.00 0.00 210 L 7.63 5.11 0.00 1.81 1.44 0.94 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 211 F 9.37 5.11 0.00 2.58 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 E 9.46 4.74 0.00 2.03 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 2.43 2.31 0.00 213 Q 9.34 5.37 0.00 2.22 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 6.48 0.00 0.00 0.00 0.00 0.00 2.42 2.51 0.00 214 H 9.55 5.45 0.00 3.12 3.19 0.00 5.90 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 E 8.54 5.92 0.00 2.20 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.20 0.00 216 S 8.67 5.39 0.00 3.78 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 0.00 217 S 8.80 5.10 0.00 3.82 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 0.00 218 V 8.57 4.79 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 0.96 0.00 0.00 0.91 0.00 0.00 219 A 8.59 4.85 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 R 8.76 4.36 0.00 1.83 1.97 0.00 2.81 0.00 0.00 3.19 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.67 0.00 221 Y 8.29 5.25 0.00 3.01 3.01 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 0.00 222 C 9.20 4.24 0.00 3.05 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 0.00 223 Q 8.56 4.54 0.00 2.22 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.86 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 224 T 7.88 4.08 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 225 C 7.77 4.66 0.00 2.97 2.90 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 0.00 226 P 0.00 4.30 0.00 2.04 1.99 0.00 3.62 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 227 S 8.37 4.63 0.00 3.80 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 0.00 228 K 8.50 4.47 0.00 1.75 1.77 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.45 7.81 229 L 8.09 4.51 0.00 1.58 1.52 0.97 1.04 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 0.00 230 G 7.75 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 0.00 231 H 7.75 4.52 0.00 3.14 3.19 0.00 5.70 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 232 N 8.38 4.35 0.00 1.70 2.16 0.00 0.00 5.88 7.56 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 * Residues marked with a * may have inaccurate shift predictions.