NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.5010 8.1927 115.4184 57.5977 64.6128 173.9955 3 L 3.2654 8.4044 122.2082 57.4108 41.5465 177.6335 4 R 3.4158 7.7306 118.6062 59.3979 30.6649 178.1132 5 S 3.9807 8.5411 114.3462 61.3323 62.9237 176.1292 6 D 4.2730 8.3834 123.0422 56.8879 40.5554 178.3448 7 L 3.8121 7.9671 120.9723 58.5032 42.0757 178.4654 8 I 3.2125 7.4535 119.3012 64.8491 36.9830 177.7095 9 N 4.0847 8.2141 116.3441 56.6369 38.5142 177.4575 10 A 4.0165 8.0772 121.9505 55.0511 18.4819 179.7318 11 L 4.0398 8.3294 117.9865 57.8463 41.7725 179.3264 12 Y 4.4055 8.0270 116.9652 61.2293 37.8399 178.1616 13 D 4.4567 8.1844 119.7700 57.3767 41.1071 178.4819 14 E 4.1067 8.3304 119.5833 59.5644 29.4898 178.0606 15 N 4.7168 8.3930 115.6456 57.1245 38.9728 176.2679 16 Q 4.1307 7.9465 119.2778 59.3479 29.4056 178.1008 17 K 3.9196 7.9561 117.4372 57.4037 32.4624 176.8625 18 Y 4.8119 7.5047 115.2854 56.0501 41.3812 174.7928 19 D 4.8976 8.7035 122.7652 52.1199 42.5612 175.9958 20 V 3.7937 7.9218 124.1022 63.1610 31.8231 175.5799 21 C 4.7456 8.5768 118.7634 56.7869 30.9728 173.1332 22 G 4.1327 7.4097 106.9647 46.4093 0.0000 172.3568 23 I 4.5964 8.1576 113.9163 59.4860 39.8049 174.6523 24 I 5.1279 8.3451 123.9641 59.4281 40.6877 174.7363 25 S 4.8827 9.0150 122.6572 56.5960 65.1239 175.0869 26 A 4.0355 8.6898 123.2534 55.2400 18.2162 178.4846 27 E 4.1843 8.1784 112.9416 56.7947 29.5655 177.6678 28 G 3.9334 8.2299 107.7947 44.9390 0.0000 173.4745 29 K 4.2923 7.7863 122.0593 55.6152 33.8210 175.3463 30 I 4.9992 8.3823 127.7203 59.8133 40.1020 173.9611 31 Y 4.8579 8.9185 124.6375 55.7425 39.5753 174.0686 32 P 4.8489 0.0000 0.0000 62.2576 32.7957 175.8555 33 L 4.2369 8.3454 121.4840 53.8341 42.1126 177.7379 34 G 3.8932 8.4750 112.8043 45.5542 0.0000 173.1800 35 S 4.3830 8.4461 114.8989 60.3073 63.3815 174.8248 36 D 4.6651 7.8534 119.3777 53.2828 39.8477 176.9934 37 T 4.1217 8.5528 111.3727 65.0863 68.6457 177.2018 38 K 3.8919 8.3808 126.2390 59.8836 31.4590 182.4080 39 V 3.7455 7.6523 118.0398 66.2077 31.5947 178.2909 40 L 3.4064 7.7168 118.3911 57.3629 41.3978 179.6529 41 S 4.2714 8.0651 114.4951 61.6058 63.0801 176.5047 42 T 3.8289 7.4994 119.3094 66.4830 68.1757 176.5707 43 I 3.5242 7.4493 121.3198 64.3444 37.0859 178.5757 44 F 3.9542 7.7124 118.9592 60.1668 38.0833 177.1880 45 E 4.1027 8.2596 118.9414 59.6564 29.2881 179.0893 46 L 4.1644 7.8989 117.4117 57.6595 41.7030 178.9479 47 F 4.3650 8.4659 120.4889 61.3783 39.5704 176.9446 48 S 4.3563 8.3897 114.5359 60.6906 62.7370 176.2835 49 R 3.7983 7.6478 120.1467 59.1180 29.8436 176.8831 50 P 4.1698 0.0000 0.0000 65.6509 31.3923 178.4270 51 I 3.5611 7.5800 117.9090 64.6056 37.0488 178.0618 52 I 3.5089 7.3775 120.0507 64.7293 36.9286 178.3855 53 N 4.3418 8.0875 116.9942 55.8812 38.2159 177.4829 54 K 3.8546 8.3830 121.5764 59.7267 32.5266 179.0038 55 I 3.7172 8.1815 120.2082 64.1321 36.9545 178.3673 56 A 4.0523 8.0304 121.6977 55.2263 18.2720 179.5388 57 E 3.8948 8.1487 117.0591 59.4647 29.4203 179.4168 58 K 4.0519 8.2750 118.1349 58.6974 32.2435 177.1340 59 H 4.9129 7.7552 112.8820 55.3086 29.7508 174.3612 60 G 3.8245 8.2212 108.9923 45.5734 0.0000 172.7492 61 Y 4.6088 8.3183 116.4740 55.9940 40.1428 175.5113 62 I 4.0552 8.1173 124.1834 60.6397 38.7181 174.9699 63 V 4.7351 8.2456 126.2944 61.5722 33.2784 174.5578 64 E 4.8617 9.3203 127.3035 54.7765 33.2349 173.8896 65 E 5.3362 9.0880 124.7960 52.8625 32.9031 173.8127 66 P 4.4868 0.0000 0.0000 63.0225 32.4105 177.1597 67 K 4.0860 8.4233 123.2690 57.8308 32.2367 179.1659 68 Q 4.1299 7.6643 117.3947 54.8592 28.3595 178.8612 69 Q 4.2340 8.6931 122.0423 56.5893 29.4989 176.1365 70 N 5.0581 7.9726 115.7310 52.7290 37.4364 174.7197 71 H 5.0392 7.9062 114.1777 54.9043 32.0252 173.6556 72 Y 4.4808 8.6991 126.0551 57.0459 40.0113 172.7731 73 P 4.3752 0.0000 0.0000 60.6891 33.6300 174.8080 74 D 4.1540 8.1755 118.8834 56.7804 41.7750 177.1357 75 F 5.1488 8.2621 116.5776 55.9295 43.0515 174.1349 76 T 5.1337 9.4476 120.7954 61.9515 70.8180 173.3128 77 L 5.3986 8.4252 126.8922 53.1577 44.7298 175.3463 78 Y 5.0986 8.2810 118.4788 56.1145 41.9959 173.9984 79 K 4.1722 8.4397 123.4417 55.2870 32.9945 175.9672 80 P 4.4306 0.0000 0.0000 65.8541 31.3939 178.0088 81 S 4.2983 7.9528 111.3497 60.5121 63.6908 174.2408 82 E 4.6079 7.9915 118.6954 53.3652 28.9753 174.0170 83 P 4.1356 0.0000 0.0000 65.4310 31.7286 177.6574 84 N 4.5115 7.7914 114.9776 53.5703 39.4698 175.1770 85 K 4.5701 7.3857 117.4554 54.7535 30.9063 176.0714 86 K 4.3355 8.8698 122.4232 56.0358 34.2362 177.0576 87 I 4.6412 8.7810 124.3394 59.4676 39.6873 174.3113 88 A 5.0746 9.0920 129.4511 50.2070 21.5078 175.4707 89 I 5.0992 8.6359 123.4063 59.6804 39.9435 174.2572 90 D 5.3869 9.5839 127.2751 52.4742 44.3811 174.5383 91 I 5.1802 8.3991 124.5403 59.8557 39.2234 175.0757 92 A 4.9672 8.8635 126.6103 50.9211 22.8117 175.0898 93 T 5.8141 8.5048 115.2785 61.8431 73.3550 172.6212 94 T 4.4042 8.4210 118.4566 62.6526 70.8331 171.8348 *95 Y 4.2791 8.0937 123.9157 55.4831 40.2120 174.0872 96 T 4.4900 8.4474 113.2251 61.4129 70.4084 174.1797 97 N 4.4537 8.7628 123.5016 54.5005 40.2919 175.6520 *102 K 4.4674 7.6826 115.2038 56.2127 33.5617 175.5145 103 I 4.7261 9.0028 118.6711 59.8813 41.4106 174.7135 104 K 5.3509 8.2901 124.7388 53.7688 36.0876 176.0010 105 F 5.0320 9.7285 119.4252 56.1790 43.4827 173.8563 106 T 5.0807 8.7162 109.5696 59.8590 70.8512 174.1867 107 L 4.7962 8.9808 123.6153 54.5500 43.2340 177.5624 108 G 3.9260 8.9726 104.9169 44.7769 0.0000 174.1169 109 G 4.1262 7.9037 107.7703 45.2990 0.0000 173.1360 110 Y 4.5107 7.7008 115.7582 56.4975 38.4406 176.6093 111 T 4.7330 7.4288 107.8996 61.4512 71.6245 173.7213 112 S 4.3998 7.4531 117.7487 58.2457 60.2566 176.5057 113 F 4.3865 8.7008 117.4226 59.5595 37.7402 177.4545 114 I 3.0553 6.6566 112.9971 62.2816 37.6495 176.5799 115 R 4.2729 7.1913 121.0181 57.3818 31.4295 176.5539 116 N 4.8480 8.0963 114.3561 50.5340 39.0661 179.0856 117 N 4.1585 7.4026 124.1103 55.1488 40.8066 175.6537 118 T 4.7701 7.7605 104.4129 60.6736 69.8573 173.1252 119 K 4.1770 8.4634 124.3719 57.1643 33.5050 176.3542 120 N 3.8886 8.7505 123.5062 53.5446 36.1419 173.4192 121 I 5.0418 7.0344 114.2852 59.5756 41.6114 174.4016 122 V 3.7334 8.4538 126.6271 65.3914 31.6191 176.0812 123 Y 4.7739 7.4973 114.6077 54.9003 41.6012 173.3647 124 P 4.5393 0.0000 0.0000 63.1121 32.3211 176.9924 125 F 4.3704 9.9828 125.4965 61.5975 39.3103 176.9486 126 D 4.5586 8.6624 118.1206 55.4759 39.2870 176.9450 127 Q 4.1216 8.2408 118.7238 56.7534 29.2571 174.7141 128 Y 4.7030 7.6686 116.7536 56.5425 39.2052 175.2859 129 I 4.5393 8.1204 116.5886 60.0864 38.7110 175.0047 130 A 4.4531 7.1359 120.8072 51.8961 22.4823 175.7711 131 H 5.0067 8.7663 117.7482 54.1375 32.3918 172.2588 132 W 5.4350 9.9291 125.0109 54.9270 32.3349 175.4089 133 I 4.9069 9.1866 124.8491 59.8299 39.0354 175.0518 134 I 4.3341 8.9479 130.3459 60.2663 38.0843 175.1419 135 G 3.1797 7.8487 115.6301 43.9885 0.0000 171.0771 136 Y 5.0773 8.7430 122.3804 55.8308 40.8028 175.1656 137 V 5.3108 9.1442 123.9676 59.2757 34.9305 174.1770 138 Y 5.2562 7.5893 118.8179 56.2671 41.9794 173.2535 139 T 5.0695 8.8985 117.7264 61.5401 70.3112 174.2462 140 R 4.4049 8.6066 127.6563 57.7879 30.4816 175.9156 141 V 3.7235 8.5365 121.8480 62.8201 31.5564 178.3180 *147 S 4.2294 9.1244 116.1271 59.0882 63.8479 171.8107 148 L 4.5700 8.5632 126.5983 55.1465 41.6397 176.6898 149 K 4.5821 7.4459 119.5808 52.8620 34.8917 177.9481 150 T 4.6913 7.7416 105.6847 61.9263 71.6125 172.6104 151 Y 4.9790 8.4843 118.9162 56.5996 43.1466 173.5808 152 N 5.3474 9.4188 117.1166 50.8331 40.6353 175.6942 153 I 3.6191 8.8280 122.1178 64.7919 37.2353 177.7624 154 N 4.6124 8.2525 115.9789 53.6425 38.0494 180.7572 155 E 4.6082 8.4655 115.4899 56.6964 30.0432 177.7852 156 L 3.7743 8.0565 121.6552 58.2863 41.5850 178.9310 157 N 4.6060 8.0108 111.6289 54.4345 38.6325 175.5059 158 E 4.2101 8.2232 117.9496 57.2684 30.2994 176.5563 159 I 3.1527 6.8775 120.0971 59.9480 37.0138 174.2295 160 P 4.2367 0.0000 0.0000 62.6884 31.8169 175.6364 161 K 4.3582 8.1185 120.3066 54.0478 33.5174 175.3423 162 P 4.9464 0.0000 0.0000 63.2819 31.7996 174.8601 163 Y 5.1625 7.5100 117.5284 56.6925 41.2425 173.5467 164 K 4.4720 9.6211 118.6504 55.4398 36.4761 175.5614 165 G 3.9827 8.7356 107.5461 46.8420 0.0000 172.9916 166 V 4.1736 7.5179 118.6243 63.0622 33.2143 175.7171 167 K 4.7346 9.3780 125.5457 54.4360 35.8547 175.4719 168 V 4.7297 8.5647 123.6809 59.7833 33.8805 174.8039 169 F 5.2008 8.4881 117.6155 55.2014 41.8118 172.8341 170 L 5.1395 8.4348 121.6307 53.5029 44.2804 175.1178 171 Q 4.4893 8.8147 125.4094 54.7801 33.2096 173.2052 172 D 4.9886 8.4038 124.0036 53.9895 41.5753 177.3145 173 K 3.8216 9.5313 125.6924 59.5121 32.0028 179.1255 174 W 3.0380 7.9534 116.3130 59.3167 28.0149 178.2150 175 V 2.7080 6.0851 118.7350 64.2689 30.7039 176.9437 176 I 4.1378 6.9832 109.3017 60.0460 38.0476 175.1556 177 A 4.6041 7.6685 124.9592 52.4155 19.1957 178.1122 178 G 4.5732 9.1365 112.0838 44.4159 0.0000 172.7571 179 D 4.6296 8.8126 117.2794 52.5399 41.0390 175.2527 180 L 5.0752 7.9256 120.5033 52.7273 44.1539 175.6151 181 A 4.5265 9.1837 125.3532 53.2941 18.5878 177.7937 182 G 4.1570 9.4943 108.2270 46.8761 0.0000 173.8441 183 S 4.3638 7.9208 113.6289 57.7474 65.5891 173.3850 184 G 3.7961 9.0898 110.4899 47.4776 0.0000 175.0184 185 N 4.4670 8.2282 122.6465 54.1851 38.1687 176.3174 186 T 4.2291 7.5835 108.1230 61.6280 69.6274 175.7309 187 T 3.3265 7.2092 108.8942 62.8412 67.4600 170.3491 188 N 5.1740 8.5883 127.5648 52.0497 41.6405 175.4411 189 I 2.6789 8.6055 123.9573 61.2323 38.4428 175.2207 190 G 4.8308 8.4002 112.6441 43.8975 0.0000 173.5615 191 S 5.1956 8.7029 119.0026 56.9276 65.0430 173.5455 192 I 3.9310 8.6662 114.3206 61.5986 38.2120 175.9536 193 H 5.0613 8.7752 123.3320 54.9191 29.7875 172.7658 194 A 4.5268 8.6013 126.0153 50.9832 22.9643 174.3657 195 H 4.9250 8.6373 112.0143 55.2492 30.2120 175.9119 196 Y 4.3595 9.2907 126.7466 61.8542 38.9428 179.2150 197 K 3.7772 8.5848 123.6674 60.2406 31.4555 180.0543 198 D 4.3560 8.1861 119.8096 57.3480 40.3981 179.1397 199 F 3.5822 7.9749 117.8664 60.1185 38.5505 178.0991 200 V 3.2973 7.0861 116.9657 65.6172 31.4572 176.4981 201 E 4.0192 8.5274 117.2905 56.0110 30.0799 176.0663 202 G 3.5721 6.9937 106.4929 46.5879 0.0000 176.1672 203 K 4.2064 7.7360 118.7872 54.7272 31.2291 177.4389 204 G 4.4328 7.6209 109.4571 43.6545 0.0000 170.2589 205 I 4.2642 7.9506 109.9955 60.9114 39.5648 176.1096 206 F 4.5103 7.9215 119.2261 57.4997 39.3666 175.1271 207 D 4.7123 10.1641 124.7595 56.2758 41.3086 176.7481 208 S 3.9505 7.5337 112.7962 56.2687 66.5744 175.2906 209 E 3.5149 6.7056 121.6746 58.7078 29.2350 177.7218 210 D 4.3188 7.7843 117.9027 57.3165 41.1865 177.8693 211 E 3.9784 8.3905 119.7657 59.2686 29.6900 178.3183 212 F 2.3000 7.8798 120.5140 60.9754 39.4448 177.1816 213 L 3.5491 8.2990 118.7088 57.4955 40.9765 179.0056 214 D 4.3920 8.0222 118.0773 57.2392 40.7282 177.6606 215 Y 3.3404 7.8694 120.2404 59.6089 38.4679 177.2486 216 W 3.9174 7.3809 117.4500 57.6667 29.7419 178.3473 217 R 4.1776 7.7247 117.2836 57.8846 29.4893 176.8896 218 N 4.9268 7.3023 113.7207 52.7224 39.5722 173.5922 219 Y 3.4990 7.1174 119.8446 56.9533 39.3212 175.1251 220 E 4.2582 7.3237 125.9091 55.3380 30.7332 177.0179 221 R 4.3255 8.4764 120.2260 58.2716 30.6391 177.6810 222 T 4.7148 7.3356 112.5812 61.0516 73.0675 175.1615 223 S 4.0677 8.5629 121.1483 62.8956 62.6857 176.9776 224 Q 3.9676 8.3121 123.4154 61.7512 27.9294 181.2063 225 L 4.2670 7.6294 122.4102 59.3716 41.2320 181.5099 226 R 3.6788 7.8656 119.0057 59.2047 29.6824 178.5303 227 N 4.3538 7.9284 115.5022 55.8099 39.0167 175.6384 228 D 4.7339 7.7857 118.0625 54.6918 41.3923 176.1228 229 K 4.4544 7.9782 117.9873 55.8546 34.4277 175.1332 230 Y 4.9090 6.6436 114.7434 56.5189 40.7873 174.4963 231 N 4.8330 8.9898 116.9171 52.4629 40.6090 174.2167 232 N 4.8995 7.8279 115.1236 51.0475 40.9527 174.8625 233 I 3.6944 8.9106 120.8685 64.1512 37.9479 177.9180 234 S 4.1589 8.1563 115.5866 61.9119 62.8338 176.5306 235 E 4.1544 8.7940 120.9243 59.2820 29.1341 178.8861 236 Y 3.4799 8.0717 120.0742 60.5176 38.9621 177.9554 237 R 3.8329 8.4500 119.0625 58.7454 29.9907 178.6450 238 N 4.3719 8.0415 116.9509 56.4585 38.9709 176.4440 239 W 4.2353 8.2707 129.7719 60.7048 30.6853 177.9292 240 I 3.2948 7.6662 119.4163 64.5155 36.3423 177.7320 241 Y 4.0645 7.5706 118.5047 60.6387 38.6543 177.6580 242 R 3.7654 7.7347 116.2451 56.2302 30.2923 176.9755 243 G 3.4729 7.0570 107.0955 45.5401 0.0000 173.9653 244 R 2.0000 7.2170 114.3430 54.3692 27.2134 176.7785 245 K 4.0620 6.6469 119.7483 57.6805 31.8638 175.4787 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 2 S 8.19 4.50 0.00 4.06 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 3 L 8.40 3.27 0.00 1.72 1.74 0.77 -0.30 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 4 R 7.73 3.42 0.00 1.75 1.74 0.00 2.86 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.57 0.00 5 S 8.54 3.98 0.00 3.96 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 6 D 8.38 4.27 0.00 2.74 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 L 7.97 3.81 0.00 1.76 1.48 0.81 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 8 I 7.45 3.21 1.68 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.33 0.14 0.00 0.00 9 N 8.21 4.08 0.00 2.79 2.86 0.00 0.00 7.06 7.48 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 10 A 8.08 4.02 1.32 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 0.00 0.00 11 L 8.33 4.04 0.00 1.54 1.73 0.79 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 12 Y 8.03 4.41 0.00 3.07 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 13 D 8.18 4.46 0.00 3.05 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 14 E 8.33 4.11 0.00 2.27 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 0.00 1.75 1.88 0.00 15 N 8.39 4.72 0.00 3.17 3.26 0.00 0.00 7.28 6.69 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 16 Q 7.95 4.13 0.00 2.44 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.79 0.00 0.00 0.00 0.00 0.00 2.40 2.45 0.00 17 K 7.96 3.92 0.00 1.53 0.95 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.61 0.00 0.00 0.00 0.00 1.47 1.35 7.81 18 Y 7.50 4.81 0.00 3.44 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 19 D 8.70 4.90 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 20 V 7.92 3.79 1.86 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 0.70 0.00 0.00 0.80 0.00 0.00 21 C 8.58 4.75 0.00 2.97 2.92 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 22 G 7.41 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 23 I 8.16 4.60 1.90 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.88 0.90 0.00 0.00 24 I 8.35 5.13 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 1.44 1.15 0.94 0.00 0.00 25 S 9.02 4.88 0.00 4.21 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 26 A 8.69 4.04 1.32 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 0.00 0.00 27 E 8.18 4.18 0.00 1.99 2.02 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 2.34 2.38 0.00 28 G 8.23 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 29 K 7.79 4.29 0.00 1.80 1.72 0.00 1.58 0.00 0.00 1.61 0.00 0.00 2.57 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.86 1.21 7.81 30 I 8.38 5.00 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 1.27 0.54 1.03 0.00 0.00 31 Y 8.92 4.86 0.00 3.02 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 32 P 0.00 4.85 0.00 2.03 2.08 0.00 3.81 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.48 0.00 33 L 8.35 4.24 0.00 1.63 1.58 0.95 0.84 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 34 G 8.48 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 0.00 0.00 0.00 35 S 8.45 4.38 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 36 D 7.85 4.67 0.00 2.85 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 37 T 8.55 4.12 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 1.31 0.00 0.00 38 K 8.38 3.89 0.00 1.78 1.89 0.00 1.79 0.00 0.00 1.74 0.00 0.00 2.81 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.09 7.81 39 V 7.65 3.75 2.18 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 0.92 0.00 0.00 0.94 0.00 0.00 40 L 7.72 3.41 0.00 1.52 1.39 0.13 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 41 S 8.07 4.27 0.00 4.18 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 42 T 7.50 3.83 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 1.17 0.00 0.00 43 I 7.45 3.52 1.29 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.36 0.44 0.00 0.00 44 F 7.71 3.95 0.00 2.70 1.78 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 45 E 8.26 4.10 0.00 2.21 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 2.49 2.58 0.00 46 L 7.90 4.16 0.00 1.69 1.76 0.91 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 47 F 8.47 4.37 0.00 2.89 3.27 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 0.00 48 S 8.39 4.36 0.00 4.36 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 49 R 7.65 3.80 0.00 2.10 2.07 0.00 3.25 0.00 0.00 3.25 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.17 0.00 50 P 0.00 4.17 0.00 2.00 2.01 0.00 3.70 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 2.00 2.12 0.00 51 I 7.58 3.56 1.75 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.59 0.81 0.00 0.00 52 I 7.38 3.51 1.44 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.73 0.36 0.00 0.00 53 N 8.09 4.34 0.00 2.78 2.84 0.00 0.00 6.73 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 K 8.38 3.85 0.00 1.84 1.92 0.00 1.60 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.45 7.81 55 I 8.18 3.72 1.82 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 1.60 0.90 0.91 0.00 0.00 56 A 8.03 4.05 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 E 8.15 3.89 0.00 2.15 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 0.00 2.32 2.68 0.00 58 K 8.28 4.05 0.00 1.72 2.05 0.00 1.78 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.36 1.46 7.81 59 H 7.76 4.91 0.00 3.54 3.58 0.00 5.72 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 G 8.22 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 61 Y 8.32 4.61 0.00 2.82 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 62 I 8.12 4.06 0.98 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.26 0.69 0.00 0.00 63 V 8.25 4.74 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 1.00 0.00 0.00 0.92 0.00 0.00 64 E 9.32 4.86 0.00 2.22 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 65 E 9.09 5.34 0.00 1.82 1.66 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 2.21 2.18 0.00 66 P 0.00 4.49 0.00 2.39 2.04 0.00 3.61 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 1.93 2.17 0.00 67 K 8.42 4.09 0.00 1.80 1.74 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.34 1.00 7.81 68 Q 7.66 4.13 0.00 2.06 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 7.05 0.00 0.00 0.00 0.00 0.00 2.28 1.95 0.00 69 Q 8.69 4.23 0.00 2.01 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.48 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 70 N 7.97 5.06 0.00 2.83 2.88 0.00 0.00 5.85 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 71 H 7.91 5.04 0.00 3.26 3.27 0.00 5.89 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 Y 8.70 4.48 0.00 3.20 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 73 P 0.00 4.38 0.00 1.66 0.49 0.00 3.72 0.00 0.00 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.51 0.00 74 D 8.18 4.15 0.00 2.71 1.74 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 75 F 8.26 5.15 0.00 2.94 2.92 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 76 T 9.45 5.13 4.52 0.00 0.00 0.00 0.00 0.00 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 77 L 8.43 5.40 0.00 1.43 1.35 0.94 0.18 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 78 Y 8.28 5.10 0.00 2.87 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 79 K 8.44 4.17 0.00 1.59 1.52 0.00 1.39 0.00 0.00 1.52 0.00 0.00 2.67 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.91 0.21 7.81 80 P 0.00 4.43 0.00 1.99 2.13 0.00 3.52 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 1.93 1.94 0.00 81 S 7.95 4.30 0.00 3.93 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 82 E 7.99 4.61 0.00 2.08 2.02 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 2.11 2.15 0.00 83 P 0.00 4.14 0.00 1.89 1.97 0.00 3.78 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 1.88 1.91 0.00 84 N 7.79 4.51 0.00 2.63 2.81 0.00 0.00 6.78 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 K 7.39 4.57 0.00 1.61 1.70 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.33 7.81 86 K 8.87 4.34 0.00 0.79 1.02 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.15 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.96 1.05 7.81 87 I 8.78 4.64 1.42 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.73 -0.36 0.00 0.00 88 A 9.09 5.07 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 I 8.64 5.10 2.12 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.76 1.10 0.00 0.00 90 D 9.58 5.39 0.00 2.95 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 91 I 8.40 5.18 2.06 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.88 1.15 0.00 0.00 92 A 8.86 4.97 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 93 T 8.50 5.81 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 1.75 0.00 0.00 94 T 8.42 4.40 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 0.37 0.00 0.00 *95 Y 8.09 4.28 0.00 2.11 2.02 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 0.00 108 G 8.97 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 0.00 109 G 7.90 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 0.00 110 Y 7.70 4.51 0.00 3.24 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 0.00 111 T 7.43 4.73 4.17 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 1.16 0.00 0.00 112 S 7.45 4.40 0.00 4.09 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 0.00 113 F 8.70 4.39 0.00 3.26 3.56 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 0.00 114 I 6.66 3.06 1.49 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.39 0.48 0.00 0.00 115 R 7.19 4.27 0.00 1.91 1.97 0.00 3.11 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.53 0.00 116 N 8.10 4.85 0.00 2.59 2.65 0.00 0.00 6.59 6.39 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 0.00 117 N 7.40 4.16 0.00 2.94 2.92 0.00 0.00 6.59 7.22 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 0.00 118 T 7.76 4.77 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 0.00 119 K 8.46 4.18 0.00 1.75 1.76 0.00 1.89 0.00 0.00 1.66 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.40 7.81 120 N 8.75 3.89 0.00 3.04 2.97 0.00 0.00 6.54 7.14 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 0.00 121 I 7.03 5.04 1.99 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.86 1.10 0.00 0.00 122 V 8.45 3.73 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 0.58 0.00 0.00 0.97 0.00 0.00 123 Y 7.50 4.77 0.00 2.66 2.83 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 0.00 124 P 0.00 4.54 0.00 2.38 2.12 0.00 3.97 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 2.19 2.19 0.00 125 F 9.98 4.37 0.00 3.19 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 0.00 126 D 8.66 4.56 0.00 2.86 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 0.00 127 Q 8.24 4.12 0.00 2.06 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 6.85 0.00 0.00 0.00 0.00 0.00 2.24 2.29 0.00 128 Y 7.67 4.70 0.00 2.63 2.56 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 0.00 129 I 8.12 4.54 1.86 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.38 0.87 0.00 0.00 130 A 7.14 4.45 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 H 8.77 5.01 0.00 3.26 3.47 0.00 5.58 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 W 9.93 5.43 0.00 3.25 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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1.61 1.23 0.00 141 V 8.54 3.72 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 1.00 0.00 0.00 *147 S 9.12 4.23 0.00 3.93 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 0.00 148 L 8.56 4.57 0.00 1.67 1.66 0.93 0.81 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 0.00 149 K 7.45 4.58 0.00 1.78 1.58 0.00 1.77 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.27 1.20 7.81 150 T 7.74 4.69 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 0.82 0.00 0.00 151 Y 8.48 4.98 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 0.00 152 N 9.42 5.35 0.00 2.77 2.87 0.00 0.00 7.41 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 0.00 153 I 8.83 3.62 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 1.29 0.55 0.93 0.00 0.00 154 N 8.25 4.61 0.00 2.76 2.72 0.00 0.00 6.96 7.82 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 0.00 155 E 8.47 4.61 0.00 2.23 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.58 0.00 156 L 8.06 3.77 0.00 1.68 1.72 0.94 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 157 N 8.01 4.61 0.00 2.66 2.83 0.00 0.00 6.86 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 0.00 158 E 8.22 4.21 0.00 2.04 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.26 0.00 159 I 6.88 3.15 1.62 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.00 0.69 0.00 0.00 160 P 0.00 4.24 0.00 2.14 2.03 0.00 3.66 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 1.99 2.03 0.00 161 K 8.12 4.36 0.00 1.26 0.74 0.00 1.32 0.00 0.00 1.63 0.00 0.00 2.84 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.21 1.31 7.81 162 P 0.00 4.95 0.00 2.17 2.28 0.00 3.79 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 2.26 1.99 0.00 163 Y 7.51 5.16 0.00 3.12 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 0.00 164 K 9.62 4.47 0.00 1.76 1.86 0.00 1.47 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.35 1.54 7.81 165 G 8.74 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 V 7.52 4.17 2.20 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 0.41 0.00 0.00 0.92 0.00 0.00 167 K 9.38 4.73 0.00 1.16 1.03 0.00 0.67 0.00 0.00 1.36 0.00 0.00 2.41 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.08 1.08 7.81 168 V 8.56 4.73 1.66 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 0.94 0.00 0.00 0.23 0.00 0.00 169 F 8.49 5.20 0.00 2.94 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 0.00 170 L 8.43 5.14 0.00 1.38 1.24 0.67 -0.22 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 0.00 171 Q 8.81 4.49 0.00 2.10 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.77 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 172 D 8.40 4.99 0.00 2.42 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.53 3.82 0.00 1.90 1.93 0.00 1.77 0.00 0.00 1.90 0.00 0.00 3.31 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.41 1.41 7.81 174 W 7.95 3.04 0.00 3.35 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 0.00 175 V 6.09 2.71 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 -0.41 0.00 0.00 176 I 6.98 4.14 1.89 0.00 0.00 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 1.35 1.12 0.69 0.00 0.00 177 A 7.67 4.60 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 G 9.14 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 0.00 0.00 0.00 0.00 179 D 8.81 4.63 0.00 2.76 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 0.00 0.00 0.00 0.00 180 L 7.93 5.08 0.00 1.79 1.79 0.99 1.05 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 0.00 181 A 9.18 4.53 1.68 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 0.00 0.00 182 G 9.49 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 0.00 0.00 0.00 0.00 183 S 7.92 4.36 0.00 3.86 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 0.00 184 G 9.09 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 0.00 0.00 0.00 185 N 8.23 4.47 0.00 2.82 2.97 0.00 0.00 5.86 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 T 7.58 4.23 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 1.19 0.00 0.00 187 T 7.21 3.33 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 1.09 0.00 0.00 188 N 8.59 5.17 0.00 2.65 2.72 0.00 0.00 7.05 7.11 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 0.00 189 I 8.61 2.68 1.54 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 -0.30 0.22 0.27 0.00 0.00 190 G 8.40 4.83 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 0.00 0.00 0.00 191 S 8.70 5.20 0.00 4.51 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 0.00 192 I 8.67 3.93 1.73 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.06 0.89 0.00 0.00 193 H 8.78 5.06 0.00 3.22 3.29 0.00 5.70 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 A 8.60 4.53 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 H 8.64 4.92 0.00 3.40 3.29 0.00 5.66 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 Y 9.29 4.36 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 0.00 197 K 8.58 3.78 0.00 1.80 1.83 0.00 1.86 0.00 0.00 1.82 0.00 0.00 2.91 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.45 1.13 7.81 198 D 8.19 4.36 0.00 2.82 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 0.00 199 F 7.97 3.58 0.00 2.31 1.64 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 0.00 200 V 7.09 3.30 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 0.76 0.00 0.00 0.37 0.00 0.00 201 E 8.53 4.02 0.00 1.89 1.88 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 2.23 2.41 0.00 202 G 6.99 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 0.00 0.00 0.00 203 K 7.74 4.21 0.00 1.84 1.66 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.39 1.23 7.81 204 G 7.62 4.43 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 0.00 205 I 7.95 4.26 1.58 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 -0.18 0.77 0.00 0.00 206 F 7.92 4.51 0.00 3.53 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 D 10.16 4.71 0.00 2.73 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 0.00 208 S 7.53 3.95 0.00 3.70 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 0.00 209 E 6.71 3.51 0.00 1.16 1.19 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 2.36 2.45 0.00 210 D 7.78 4.32 0.00 2.78 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 E 8.39 3.98 0.00 2.20 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 0.00 2.58 2.65 0.00 212 F 7.88 2.30 0.00 2.49 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 0.00 213 L 8.30 3.55 0.00 1.69 1.65 1.17 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 214 D 8.02 4.39 0.00 2.99 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 0.00 215 Y 7.87 3.34 0.00 2.15 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 0.00 216 W 7.38 3.92 0.00 2.80 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 0.00 217 R 7.72 4.18 0.00 1.86 2.00 0.00 3.22 0.00 0.00 3.23 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.64 0.00 218 N 7.30 4.93 0.00 2.69 2.59 0.00 0.00 6.94 7.12 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 0.00 219 Y 7.12 3.50 0.00 2.15 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 0.00 0.00 0.00 220 E 7.32 4.26 0.00 1.54 1.62 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 1.80 1.97 0.00 221 R 8.48 4.33 0.00 1.82 2.05 0.00 3.22 0.00 0.00 3.90 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.78 0.00 222 T 7.34 4.71 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 1.23 0.00 0.00 223 S 8.56 4.07 0.00 3.83 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 0.00 224 Q 8.31 3.97 0.00 2.14 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 7.06 0.00 0.00 0.00 0.00 0.00 2.29 2.03 0.00 225 L 7.63 4.27 0.00 1.64 1.71 0.92 0.81 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 0.00 226 R 7.87 3.68 0.00 1.76 1.83 0.00 2.21 0.00 0.00 2.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 1.49 0.00 227 N 7.93 4.35 0.00 2.89 2.80 0.00 0.00 7.20 8.08 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 0.00 228 D 7.79 4.73 0.00 2.78 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 0.00 229 K 7.98 4.45 0.00 1.45 1.03 0.00 1.74 0.00 0.00 1.40 0.00 0.00 2.56 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.50 1.22 7.81 230 Y 6.64 4.91 0.00 3.15 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 0.00 231 N 8.99 4.83 0.00 2.88 2.86 0.00 0.00 6.79 8.77 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 0.00 232 N 7.83 4.90 0.00 3.19 2.97 0.00 0.00 5.86 7.80 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 0.00 233 I 8.91 3.69 1.38 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 1.12 1.33 0.78 0.00 0.00 234 S 8.16 4.16 0.00 4.14 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 0.00 235 E 8.79 4.15 0.00 2.21 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 0.00 2.41 2.52 0.00 236 Y 8.07 3.48 0.00 2.19 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 0.00 237 R 8.45 3.83 0.00 2.08 2.00 0.00 3.35 0.00 0.00 3.16 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 2.01 0.00 238 N 8.04 4.37 0.00 2.87 3.01 0.00 0.00 6.68 7.26 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 0.00 239 W 8.27 4.24 0.00 3.54 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 0.00 240 I 7.67 3.29 1.89 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 0.92 0.20 0.82 0.00 0.00 241 Y 7.57 4.06 0.00 2.96 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 0.00 242 R 7.73 3.77 0.00 1.75 1.79 0.00 3.23 0.00 0.00 3.32 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.92 0.00 243 G 7.06 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 244 R 7.22 2.00 0.00 1.43 1.06 0.00 3.02 0.00 0.00 3.06 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.95 0.00 245 K 6.65 4.06 0.00 1.73 1.52 0.00 1.56 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.07 1.25 7.81 * Residues marked with a * may have inaccurate shift predictions.