NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 H 4.6198 8.3033 116.4782 55.8551 29.0449 174.2054 *2 L 4.1610 7.8781 120.5924 55.1549 44.5147 178.2928 3 I 4.5355 7.4076 118.6029 59.1535 40.7521 174.2254 4 Q 4.7882 8.9292 127.4971 54.3190 32.1374 173.5227 5 L 4.9804 9.0608 127.3593 53.0895 44.4032 174.9739 6 D 4.8392 8.9603 124.4613 52.1561 43.2299 176.1701 7 Q 3.5512 8.8676 129.6297 56.7540 27.1101 174.0345 8 I 4.4748 7.9790 111.6671 60.7086 39.9312 176.5988 9 G 4.5623 8.7045 109.5854 43.5896 0.0000 171.1576 10 R 4.9288 8.6515 120.1156 54.1686 34.8126 173.8567 *12 K 4.1848 8.3828 121.6696 57.4195 32.8358 175.4877 13 Q 3.5510 10.0231 124.4074 56.8472 26.3166 174.8616 14 G 3.9755 8.6113 106.1380 45.0226 0.0000 174.3331 15 K 4.3733 7.5090 119.2190 55.1914 33.2944 176.4789 16 T 4.1852 8.3709 120.2739 63.4450 69.0358 174.2982 17 I 4.1821 9.1467 128.0942 62.4645 38.3690 176.0669 18 L 5.1184 7.5526 118.6290 52.6103 45.0165 175.3621 19 K 4.5962 8.7877 123.0314 55.8142 35.2088 176.3979 20 K 3.7424 8.6519 126.0238 57.4549 29.7490 175.5540 21 I 4.2260 7.9938 119.6566 60.5428 38.7427 176.6115 22 S 5.3023 8.5649 123.4046 56.4460 65.3330 173.7583 23 W 5.2632 9.2162 134.1758 56.3138 34.4098 173.0143 24 Q 5.0000 8.9905 125.7047 54.0868 31.2158 174.7660 25 I 4.6987 8.6962 124.7893 59.4419 40.1241 174.7310 26 A 5.1776 9.2860 128.5615 49.3234 22.5128 175.7019 27 K 4.0617 8.6984 119.1065 58.5200 32.4790 178.2763 28 G 4.0776 8.6936 111.3004 44.9712 0.0000 173.5852 29 D 4.4565 8.0480 120.7202 54.3104 42.4777 175.7115 30 K 4.4596 8.4762 121.6036 54.6301 34.8909 174.7622 31 W 5.4361 9.1332 125.2307 55.1337 32.0889 175.2421 32 I 5.0290 9.5073 125.1386 60.1115 38.9933 174.4313 33 L 4.9588 9.1428 129.8600 53.8703 43.5628 174.2006 34 Y 5.0679 7.8730 128.1323 54.7372 41.5504 174.6339 35 G 4.3439 7.3114 111.2273 45.7338 0.0000 172.8686 36 L 4.3292 8.0435 120.4836 53.9213 42.4137 176.6764 37 N 4.3637 8.3539 117.6826 55.4822 37.4754 175.8790 38 G 3.9023 9.0434 109.9810 45.3259 0.0000 174.5905 39 A 3.8565 7.7937 122.5613 53.4071 18.9121 179.3940 40 G 3.9745 7.7644 104.6081 45.4068 0.0000 175.7254 41 K 3.9581 8.2175 120.8991 59.6558 31.9316 179.2715 42 T 3.9507 7.8630 115.4182 66.9531 68.4975 176.6883 43 T 3.8891 7.9215 117.1984 66.5452 68.5894 176.2153 44 L 3.9949 8.0902 122.1694 58.2131 42.0629 179.0128 45 L 4.0337 8.2149 119.0062 57.9016 41.4347 179.1930 46 N 4.4594 8.6195 116.8112 56.3371 38.5383 177.5659 47 I 4.1269 7.5867 122.4428 63.9383 37.0289 178.4585 48 L 3.9559 7.5408 118.2227 57.7462 41.5810 178.6647 49 N 4.3190 8.1701 113.1068 52.5923 38.6130 174.9185 50 A 3.7909 7.4054 121.8782 53.4296 16.7411 178.4719 51 Y 4.5807 8.0374 119.3711 61.3636 38.5688 176.3377 52 E 4.7927 7.8488 118.3624 53.7506 33.5708 172.6233 53 P 4.5911 0.0000 0.0000 61.3578 32.7134 175.8427 54 A 4.1570 8.4295 123.6689 53.2923 18.7034 177.7837 55 T 4.2615 8.6467 118.2730 64.8666 69.3425 174.9202 56 S 4.4174 7.6955 114.5221 58.0027 65.8314 174.4129 57 G 3.9461 8.8591 108.9136 45.5219 0.0000 172.2384 58 T 4.6394 8.0235 107.2944 59.6732 71.7771 173.2414 59 V 4.4782 8.3587 123.9750 61.0525 33.9707 173.8916 60 N 4.9288 9.2024 127.2630 51.9627 41.5525 173.1654 61 L 4.3093 8.8285 128.0501 52.7582 43.6853 176.8918 62 F 3.7899 9.1280 125.4581 58.3522 36.8922 177.2451 63 G 3.9178 8.5884 108.6471 45.1575 0.0000 173.9174 64 K 4.4717 7.6967 119.0977 53.9322 34.6709 173.1077 *66 P 3.3185 0.0000 0.0000 63.4463 31.8554 177.1398 67 G 4.0436 8.6596 113.6115 46.0295 0.0000 172.6160 *71 Y 4.4405 7.7455 119.1536 57.0408 39.8556 174.7532 72 S 4.3036 7.1792 119.5007 55.7502 67.1279 175.1988 73 A 3.7149 8.2812 126.7373 55.0818 18.1008 179.4420 74 E 3.7874 8.0026 117.3602 59.8142 29.4347 179.1592 75 T 3.9386 7.3868 114.2703 66.4963 68.7966 176.4623 76 V 3.7417 7.3385 119.9110 66.2634 31.5617 178.3721 77 R 3.9292 8.0185 117.2444 58.8250 29.6097 178.8589 78 Q 3.9974 7.5192 117.2690 58.3919 28.8503 177.3391 79 H 4.2139 7.7347 115.9782 55.0838 28.9452 174.3006 80 I 4.9070 7.0331 122.0530 59.2241 40.0398 175.2026 81 G 4.0844 9.2817 114.6080 44.6626 0.0000 172.0318 82 F 5.6460 8.9598 128.7679 56.3694 41.7592 174.5364 83 V 4.1428 9.0542 127.2810 61.3174 33.0307 174.2559 84 S 4.6120 7.8080 121.4738 56.4521 66.2576 174.1382 85 H 4.1146 8.8491 122.3735 59.0060 30.2496 177.4117 86 S 4.2371 8.1325 113.8371 61.1807 63.1287 176.2880 87 L 4.0999 7.6921 121.0313 56.8412 41.7320 178.8005 88 L 4.0682 7.3627 118.5898 57.7934 40.6436 177.5473 89 E 4.3139 7.7391 116.1094 56.9425 29.8422 178.0354 90 K 3.8083 7.5695 117.1853 58.1952 33.0413 177.1187 91 F 4.7188 7.2537 118.1230 55.9949 40.6994 174.9633 92 Q 4.7242 8.4447 120.7589 54.0590 30.8750 176.4873 93 E 3.8521 8.8979 119.9350 59.9096 29.5332 179.2707 94 G 3.4567 7.7401 103.4663 45.5297 0.0000 173.0730 95 E 4.3232 8.0950 121.3349 55.4813 30.5264 176.6513 96 R 4.6096 8.5462 122.5373 55.7456 32.2386 177.7549 97 V 3.4977 8.6644 123.1392 66.4242 31.4473 178.3909 98 I 3.5900 7.8423 118.0736 64.3875 37.7921 177.5801 99 D 4.3303 7.9913 119.1540 57.1679 40.4970 178.6902 100 V 3.3943 7.5440 118.2045 65.7055 31.6172 178.1081 101 V 3.6255 7.7540 117.9123 66.0877 31.4084 177.7319 102 I 3.6697 7.9035 120.1911 64.7500 36.8268 178.2455 103 S 4.3509 7.9392 112.9595 60.7496 62.7734 176.2405 104 G 3.8345 8.3999 110.0545 44.2692 0.0000 173.7117 105 A 4.1519 8.3747 124.5373 52.8282 16.6522 180.1853 *115 I 3.9280 8.7592 117.7255 61.7358 38.6863 174.3113 116 D 4.9381 8.0939 122.8373 50.8245 42.8940 175.5643 117 D 4.3644 8.6466 117.4060 57.2269 40.3947 178.3430 118 E 4.1041 8.2139 119.4128 58.7130 29.9574 178.2390 119 I 3.7242 8.1363 119.9572 64.2645 37.1912 178.3629 120 R 3.8852 8.2074 119.7395 59.4363 29.9169 178.0453 121 N 4.3513 8.0913 116.4527 56.6896 39.0624 176.4098 122 E 3.9595 8.6589 120.9389 59.2069 29.6924 178.7232 123 A 4.0128 8.1099 120.9012 55.4875 18.5708 179.3745 124 H 4.1762 8.3723 114.7581 59.0221 28.7169 178.1544 125 Q 4.0657 8.2325 120.0523 58.9334 28.5665 178.6409 126 L 4.1178 7.9314 119.6842 57.6941 41.3849 179.5241 127 L 4.0089 7.7840 118.3875 57.4700 41.8097 179.0760 128 K 4.0796 7.9808 119.1503 59.6841 31.9710 178.8562 129 L 4.1036 7.8147 117.7323 57.2945 41.5423 178.3943 130 V 4.0745 7.6265 109.8431 60.6979 31.9037 175.1076 131 G 3.5468 7.5880 110.2427 45.9896 0.0000 173.5544 *133 S 4.4830 7.8519 118.4012 58.8724 65.2424 176.5889 134 A 4.0541 8.0939 121.1621 54.3641 18.5696 178.0181 135 K 4.5067 7.8666 113.7259 56.1585 32.8145 177.9789 136 A 3.9862 7.9589 125.6380 55.1939 18.2772 180.0757 137 Q 4.3453 7.8525 111.6094 56.3439 29.6119 175.9994 138 Q 4.1935 7.6088 118.1762 54.9436 29.8534 175.0632 139 Y 4.8568 8.0784 118.9854 58.0355 38.6899 177.4019 140 I 3.6987 9.1557 125.3869 63.5677 38.3819 178.0203 141 G 3.6524 8.1496 109.3149 48.7444 0.0000 173.9123 142 Y 4.6193 7.9618 115.2001 58.7475 38.2924 175.5502 143 L 4.7096 7.5383 120.3640 53.3919 43.2034 177.1517 144 S 4.4876 8.9279 117.0258 58.0985 65.1967 175.6338 145 T 3.9609 8.4909 118.7086 66.7549 68.2660 176.8985 146 G 3.6766 8.0966 106.9465 47.9817 0.0000 175.3102 147 E 4.0081 8.3288 121.4293 59.0458 29.2695 179.6003 148 K 3.9635 8.1601 117.6431 59.6857 32.1579 179.1262 149 Q 4.1435 7.9828 117.4402 58.9144 28.8994 178.6158 150 R 4.1591 7.9991 119.0469 58.8461 29.9648 179.7480 151 V 3.5305 7.6586 116.2315 63.2893 31.5046 177.7993 *153 I 4.0408 7.7809 118.8775 60.8575 39.0158 177.8880 154 A 3.9943 8.0025 120.5900 55.1583 18.2266 179.1602 155 R 3.9337 8.3016 117.3253 59.7373 29.9006 178.6307 156 A 4.1740 7.9328 118.6368 54.0535 19.5373 178.3523 157 L 4.2317 7.5433 118.6497 53.3241 39.7612 177.6420 *159 G 3.4919 7.9681 114.7830 45.6916 0.0000 169.9745 160 Q 3.1714 7.5666 116.3069 55.9264 27.9973 171.4673 161 P 4.4711 0.0000 0.0000 62.6695 32.9715 176.1499 162 Q 4.3754 8.6728 117.9510 57.0876 30.4072 176.0170 163 V 4.9424 7.7119 118.5128 60.8401 35.1569 173.7455 164 L 5.1772 9.1530 130.3340 53.5885 43.7070 175.2972 165 I 4.8006 9.5036 128.4444 59.6795 39.7856 174.6333 166 L 4.9500 9.2086 128.2279 53.1179 43.8210 175.5864 167 D 4.6669 9.2300 126.2638 52.3158 41.3391 176.3840 168 E 3.7814 8.2879 130.0518 56.7850 27.4992 175.1438 169 P 4.2294 0.0000 0.0000 64.8676 32.4655 177.4848 170 A 4.5169 7.8873 120.8138 51.5393 19.1946 176.1526 171 A 4.2401 7.6489 121.2919 54.2477 18.6119 179.0891 172 G 4.0476 9.0003 111.2583 45.4071 0.0000 173.7108 173 L 4.2340 7.5024 120.1389 54.1589 42.3918 177.4248 174 D 4.7539 8.3931 122.8996 52.4685 42.1782 176.9159 175 F 4.2016 8.7535 119.9303 61.7708 39.2752 177.0457 176 I 3.5173 7.9355 118.5990 64.2250 37.0214 178.1594 177 A 3.9785 8.4254 121.6852 55.0041 18.1632 179.5418 178 R 3.8347 8.1789 117.4582 59.8634 30.1811 178.7104 179 E 3.8399 7.9125 118.2178 58.9808 29.3187 179.2106 180 S 4.0150 8.0286 113.4151 61.3100 62.5137 175.9857 181 L 3.9872 7.8856 122.8709 58.2682 41.9179 178.9397 182 L 4.0535 8.1421 119.0206 57.8384 41.5547 179.4270 183 S 4.1360 8.5867 113.5558 61.4022 62.2127 176.2173 184 I 3.7676 7.8861 122.5472 64.4608 36.8628 178.3490 185 L 4.1398 8.0536 119.7029 57.9454 41.3112 179.3411 186 D 4.4092 8.1313 118.4015 57.4089 40.7387 178.9893 187 S 4.1393 8.1367 115.6147 61.7051 62.7947 176.7809 188 L 4.1660 8.3459 121.9912 57.9220 41.1210 179.5839 189 S 4.1481 7.9673 112.3079 61.2477 62.3308 175.7136 190 D 4.4683 7.6154 121.1387 57.5434 40.6825 178.6280 191 S 4.1906 7.8848 114.3871 60.0130 64.3267 174.2445 192 Y 4.7988 8.0338 119.3265 54.8802 38.1020 173.8993 193 P 4.3993 0.0000 0.0000 65.3727 32.2159 178.4312 194 T 4.2096 7.8613 106.4301 62.3388 69.5166 173.8886 195 L 4.3769 7.7670 125.6531 55.4634 42.7520 176.7037 196 A 5.2340 8.4143 128.6831 50.2836 22.1337 175.1348 *198 I 4.7374 8.0625 116.1826 61.8837 39.0562 174.4899 199 Y 4.8206 9.7755 129.3111 55.8606 40.9867 174.2772 200 V 4.7907 8.3413 128.0861 61.9211 33.1228 174.5627 201 T 4.8352 8.6017 120.6752 61.8391 70.9088 173.5411 202 H 4.0974 8.8225 121.5244 55.5257 29.8860 175.0676 203 F 5.1581 8.1153 119.6561 55.3835 40.8934 176.1893 204 I 4.0066 8.7639 119.8252 63.1139 37.7607 177.8663 205 E 4.5220 8.4043 119.4427 58.4699 29.3478 177.3748 206 E 4.2389 8.2429 116.5823 56.8420 29.9555 176.4261 207 I 3.8669 7.6382 121.3674 60.4871 37.1969 175.7578 208 T 4.4597 8.0773 115.6922 59.8205 70.4583 175.5704 209 A 4.0274 8.5988 125.0465 55.3406 18.5428 178.6032 210 N 4.2188 8.3665 113.4299 56.4308 39.0237 174.5850 211 F 4.2631 8.3437 118.0130 56.7762 38.3385 175.2210 212 S 4.7256 8.3936 120.3202 57.9597 64.9061 173.7654 213 K 4.8291 7.8721 120.1344 54.5660 35.5749 174.9738 214 I 5.3469 8.6968 122.6189 59.4435 42.2695 173.3318 215 L 5.1065 9.2659 130.4572 53.2734 44.6755 174.9162 216 L 4.7747 8.7839 127.5605 53.6242 42.9782 175.3232 217 L 5.2271 9.0825 127.1697 53.0954 44.1454 175.7344 218 K 4.4155 9.0523 126.8188 56.1415 35.2247 175.6943 219 D 4.3369 9.8544 126.5277 55.5454 38.6635 174.4879 220 G 4.1838 8.2761 102.9876 46.3069 0.0000 173.3746 221 Q 4.7192 7.9573 118.1981 53.4989 31.9616 174.8053 222 S 4.6249 8.5211 116.6160 58.0971 62.6395 173.7797 223 I 4.0898 8.8267 129.9760 63.5368 37.5517 176.4920 224 Q 4.6624 7.5758 117.6404 54.1939 32.6732 173.9717 225 Q 5.7388 7.9190 116.7981 53.4583 32.4182 176.0683 226 G 3.9339 8.1543 106.4748 45.6784 0.0000 171.0746 227 A 4.5044 7.8485 124.4315 51.4393 20.3072 178.1633 228 V 3.4285 8.4859 124.8869 66.2887 31.3736 178.5405 229 E 4.2070 8.1409 115.3389 59.2568 29.5349 178.1693 230 D 4.5319 7.8177 118.6240 56.5331 41.3477 178.1803 231 I 4.0455 7.5096 119.2030 63.0937 38.7398 177.7044 232 L 4.1296 7.3953 120.7270 54.2741 38.8690 176.1341 233 T 4.7790 7.3031 110.3557 59.1318 72.3565 175.0944 234 S 4.2949 9.0120 119.0996 62.0897 63.3691 175.9612 235 E 4.0897 8.3591 120.1032 59.5824 29.6854 179.1496 236 N 4.3497 8.0104 113.4684 54.0994 38.1861 177.1939 *238 S 5.2355 8.1026 115.9789 59.0528 64.9108 176.4871 239 R 3.9268 7.9722 117.8019 59.3243 30.0703 177.8941 240 F 4.2779 8.2048 118.7127 61.2969 39.2341 176.2393 241 F 4.5455 8.0215 116.1563 57.8543 39.2953 175.4147 242 Q 3.6308 7.8793 118.4930 56.1269 26.9196 173.7305 243 K 4.6082 7.6780 114.0754 54.7903 36.3926 175.7350 244 N 4.5832 8.8076 120.3848 53.6267 38.3511 174.7907 245 V 4.8925 8.5997 116.3326 59.3244 35.5176 175.1150 246 A 4.8335 9.3527 125.1104 50.1735 21.0949 175.9392 247 V 4.7244 9.1256 122.6854 61.0930 34.0271 174.6835 248 Q 4.7146 9.0686 127.8006 54.3224 32.7286 173.7890 249 R 4.5625 8.6750 125.5775 54.3792 31.4104 175.3205 250 W 5.0594 8.8009 135.0000 57.0547 33.8285 174.3707 251 N 3.9137 9.0387 122.5732 54.5027 35.5176 174.0990 252 N 4.1141 8.2612 109.3089 54.0096 36.4494 174.2712 253 R 4.6907 7.5726 115.9597 54.4505 34.2618 173.8378 254 F 5.4323 8.6196 117.3260 56.2467 41.9857 175.4367 255 S 5.0568 8.8986 117.3254 56.8430 66.2292 171.6536 *257 A 4.3351 8.2585 119.4307 52.3009 21.3727 177.6070 *259 L 4.0546 8.4916 114.1217 55.8129 42.1590 176.6737 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 0 H 8.30 4.62 0.00 3.24 3.58 0.00 5.45 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *2 L 7.88 4.16 0.00 1.63 1.58 1.01 0.86 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 3 I 7.41 4.54 1.37 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 -0.36 0.54 0.00 0.00 4 Q 8.93 4.79 0.00 1.95 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.78 0.00 0.00 0.00 0.00 0.00 2.19 2.26 0.00 5 L 9.06 4.98 0.00 1.71 1.57 1.06 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 6 D 8.96 4.84 0.00 2.75 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 Q 8.87 3.55 0.00 2.15 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 6.72 0.00 0.00 0.00 0.00 0.00 2.30 2.42 0.00 8 I 7.98 4.47 1.86 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 1.18 0.86 0.96 0.00 0.00 9 G 8.70 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 10 R 8.65 4.93 0.00 1.80 1.72 0.00 3.30 0.00 0.00 3.10 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.71 0.00 *12 K 8.38 4.18 0.00 1.86 1.72 0.00 1.92 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.41 1.48 7.81 13 Q 10.02 3.55 0.00 2.21 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 5.32 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 14 G 8.61 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 15 K 7.51 4.37 0.00 1.84 1.74 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.80 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.54 7.81 16 T 8.37 4.19 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 1.24 0.00 0.00 17 I 9.15 4.18 1.96 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.63 0.91 0.00 0.00 18 L 7.55 5.12 0.00 1.73 1.49 0.93 0.97 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 19 K 8.79 4.60 0.00 1.59 1.61 0.00 1.94 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.33 1.37 7.81 20 K 8.65 3.74 0.00 1.89 1.81 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.81 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.43 7.81 21 I 7.99 4.23 1.87 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.94 0.87 0.00 0.00 22 S 8.56 5.30 0.00 3.74 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 23 W 9.22 5.26 0.00 3.16 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 24 Q 8.99 5.00 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.48 0.00 0.00 0.00 0.00 0.00 2.22 2.38 0.00 25 I 8.70 4.70 1.41 0.00 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.05 -0.34 0.82 0.00 0.00 26 A 9.29 5.18 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 K 8.70 4.06 0.00 1.77 1.93 0.00 1.79 0.00 0.00 1.75 0.00 0.00 3.04 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.54 1.66 7.81 28 G 8.69 4.08 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 0.00 0.00 0.00 29 D 8.05 4.46 0.00 3.04 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 30 K 8.48 4.46 0.00 1.42 0.89 0.00 1.35 0.00 0.00 1.77 0.00 0.00 2.88 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.42 0.77 7.81 31 W 9.13 5.44 0.00 3.58 3.52 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 32 I 9.51 5.03 2.03 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.12 1.10 0.00 0.00 33 L 9.14 4.96 0.00 1.97 1.71 0.64 0.56 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 34 Y 7.87 5.07 0.00 3.11 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 35 G 7.31 4.34 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 0.00 36 L 8.04 4.33 0.00 1.72 1.59 0.95 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 37 N 8.35 4.36 0.00 2.63 2.74 0.00 0.00 7.11 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 38 G 9.04 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 A 7.79 3.86 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 G 7.76 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 41 K 8.22 3.96 0.00 1.80 1.88 0.00 1.72 0.00 0.00 1.79 0.00 0.00 2.90 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.50 1.50 7.81 42 T 7.86 3.95 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 1.27 0.00 0.00 43 T 7.92 3.89 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 44 L 8.09 3.99 0.00 1.87 1.90 1.04 0.31 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 45 L 8.21 4.03 0.00 1.96 1.64 1.14 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 46 N 8.62 4.46 0.00 2.98 2.97 0.00 0.00 7.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 I 7.59 4.13 2.07 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 1.70 2.37 0.91 0.00 0.00 48 L 7.54 3.96 0.00 1.70 1.63 0.83 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 49 N 8.17 4.32 0.00 2.54 2.21 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 50 A 7.41 3.79 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 51 Y 8.04 4.58 0.00 3.12 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 52 E 7.85 4.79 0.00 2.02 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 2.33 2.35 0.00 53 P 0.00 4.59 0.00 2.16 2.04 0.00 3.81 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 1.97 1.97 0.00 54 A 8.43 4.16 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 T 8.65 4.26 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 1.20 0.00 0.00 56 S 7.70 4.42 0.00 3.94 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 57 G 8.86 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 0.00 0.00 0.00 58 T 8.02 4.64 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 1.18 0.00 0.00 59 V 8.36 4.48 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 0.75 0.00 0.00 0.89 0.00 0.00 60 N 9.20 4.93 0.00 2.68 2.64 0.00 0.00 6.59 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 F 8.96 5.65 0.00 2.91 3.02 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 83 V 9.05 4.14 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 0.66 0.00 0.00 0.94 0.00 0.00 84 S 7.81 4.61 0.00 2.82 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 H 8.85 4.11 0.00 3.23 3.27 0.00 5.93 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 86 S 8.13 4.24 0.00 4.01 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 87 L 7.69 4.10 0.00 1.80 1.78 0.81 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 88 L 7.36 4.07 0.00 1.60 1.78 0.98 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 89 E 7.74 4.31 0.00 2.26 1.92 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 2.15 2.33 0.00 90 K 7.57 3.81 0.00 1.59 1.76 0.00 1.34 0.00 0.00 1.39 0.00 0.00 2.13 0.00 0.00 2.41 0.00 0.00 0.00 0.00 1.42 0.24 7.81 91 F 7.25 4.72 0.00 3.14 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 92 Q 8.44 4.72 0.00 2.18 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.64 0.00 0.00 0.00 0.00 0.00 2.43 2.30 0.00 93 E 8.90 3.85 0.00 1.95 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 2.35 2.32 0.00 94 G 7.74 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 0.00 0.00 0.00 95 E 8.09 4.32 0.00 2.21 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 2.38 2.33 0.00 96 R 8.55 4.61 0.00 2.09 1.86 0.00 3.18 0.00 0.00 3.38 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.88 0.00 97 V 8.66 3.50 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.98 0.00 0.00 98 I 7.84 3.59 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.47 0.92 0.00 0.00 116 D 8.09 4.94 0.00 2.84 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 0.00 117 D 8.65 4.36 0.00 2.71 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 0.00 118 E 8.21 4.10 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 2.36 2.40 0.00 119 I 8.14 3.72 1.99 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.57 0.91 0.00 0.00 120 R 8.21 3.89 0.00 1.85 2.09 0.00 3.29 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.82 0.00 121 N 8.09 4.35 0.00 3.01 3.00 0.00 0.00 6.88 7.02 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 0.00 122 E 8.66 3.96 0.00 2.19 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 0.00 2.32 2.36 0.00 123 A 8.11 4.01 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 0.00 124 H 8.37 4.18 0.00 3.43 3.35 0.00 5.62 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Q 8.23 4.07 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.74 2.57 0.00 126 L 7.93 4.12 0.00 1.88 1.74 0.98 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 127 L 7.78 4.01 0.00 1.81 1.74 0.85 0.93 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 0.00 128 K 7.98 4.08 0.00 2.01 1.98 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.50 7.81 129 L 7.81 4.10 0.00 1.88 1.80 0.93 1.14 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 0.00 130 V 7.63 4.07 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 0.70 0.00 0.00 1.09 0.00 0.00 131 G 7.59 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 0.00 0.00 0.00 *133 S 7.85 4.48 0.00 3.93 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 0.00 134 A 8.09 4.05 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 K 7.87 4.51 0.00 1.81 1.79 0.00 1.80 0.00 0.00 1.84 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.40 7.81 136 A 7.96 3.99 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 Q 7.85 4.35 0.00 2.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.92 0.00 0.00 0.00 0.00 0.00 2.32 2.30 0.00 138 Q 7.61 4.19 0.00 2.26 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.99 0.00 0.00 0.00 0.00 0.00 2.45 2.46 0.00 139 Y 8.08 4.86 0.00 2.67 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 0.00 140 I 9.16 3.70 1.84 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.33 0.99 0.00 0.00 141 G 8.15 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 0.00 0.00 0.00 142 Y 7.96 4.62 0.00 3.16 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 0.00 143 L 7.54 4.71 0.00 1.88 1.62 1.04 0.86 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 0.00 144 S 8.93 4.49 0.00 4.06 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 0.00 145 T 8.49 3.96 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 1.24 0.00 0.00 146 G 8.10 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 0.00 0.00 0.00 147 E 8.33 4.01 0.00 2.28 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 0.00 2.34 2.37 0.00 148 K 8.16 3.96 0.00 1.88 1.88 0.00 1.72 0.00 0.00 1.72 0.00 0.00 3.20 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.48 1.62 7.81 149 Q 7.98 4.14 0.00 2.22 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.98 0.00 0.00 0.00 0.00 0.00 2.54 2.68 0.00 150 R 8.00 4.16 0.00 2.03 1.99 0.00 3.41 0.00 0.00 3.12 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.65 0.00 151 V 7.66 3.53 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 0.98 0.00 0.00 0.97 0.00 0.00 *153 I 7.78 4.04 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 1.40 0.97 0.97 0.00 0.00 154 A 8.00 3.99 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 0.00 155 R 8.30 3.93 0.00 1.86 1.92 0.00 3.06 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.78 0.00 156 A 7.93 4.17 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 L 7.54 4.23 0.00 1.80 1.48 0.92 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 *159 G 7.97 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 168 E 8.29 3.78 0.00 2.16 1.92 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 2.28 2.18 0.00 169 P 0.00 4.23 0.00 2.16 2.07 0.00 3.14 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.43 0.00 170 A 7.89 4.52 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 0.00 0.00 0.00 0.00 0.00 0.00 171 A 7.65 4.24 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 G 9.00 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 0.00 173 L 7.50 4.23 0.00 1.78 1.64 1.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 174 D 8.39 4.75 0.00 3.02 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 0.00 175 F 8.75 4.20 0.00 3.11 3.13 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 0.00 176 I 7.94 3.52 1.90 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 1.73 1.10 0.90 0.00 0.00 177 A 8.43 3.98 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 0.00 178 R 8.18 3.83 0.00 1.96 2.07 0.00 3.19 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.75 0.00 179 E 7.91 3.84 0.00 1.67 1.75 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 1.63 1.51 0.00 180 S 8.03 4.02 0.00 3.93 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 0.00 181 L 7.89 3.99 0.00 1.81 1.86 0.97 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 182 L 8.14 4.05 0.00 1.83 1.69 0.93 0.43 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 0.00 183 S 8.59 4.14 0.00 3.87 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 0.00 184 I 7.89 3.77 2.09 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 1.77 0.99 0.97 0.00 0.00 185 L 8.05 4.14 0.00 2.09 2.04 1.25 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 186 D 8.13 4.41 0.00 2.92 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 0.00 187 S 8.14 4.14 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 0.00 188 L 8.35 4.17 0.00 1.93 1.89 1.02 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 189 S 7.97 4.15 0.00 3.87 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 0.00 190 D 7.62 4.47 0.00 2.82 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 0.00 191 S 7.88 4.19 0.00 3.68 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 0.00 192 Y 8.03 4.80 0.00 3.06 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 0.00 193 P 0.00 4.40 0.00 2.19 2.11 0.00 3.62 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.07 0.00 194 T 7.86 4.21 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 1.25 0.00 0.00 195 L 7.77 4.38 0.00 1.75 1.91 0.91 0.96 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 0.00 196 A 8.41 5.23 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *198 I 8.06 4.74 2.06 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.75 1.26 0.00 0.00 199 Y 9.78 4.82 0.00 2.77 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 V 8.34 4.79 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 0.86 0.00 0.00 1.06 0.00 0.00 201 T 8.60 4.84 4.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 202 H 8.82 4.10 0.00 2.54 2.67 0.00 5.89 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 F 8.12 5.16 0.00 3.26 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 0.00 204 I 8.76 4.01 1.75 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.92 0.60 0.00 0.00 205 E 8.40 4.52 0.00 2.11 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 0.00 2.42 2.72 0.00 206 E 8.24 4.24 0.00 2.28 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 0.00 2.47 2.48 0.00 207 I 7.64 3.87 2.11 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.59 1.00 0.00 0.00 208 T 8.08 4.46 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 209 A 8.60 4.03 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 N 8.37 4.22 0.00 2.77 3.00 0.00 0.00 6.98 7.02 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 0.00 211 F 8.34 4.26 0.00 3.20 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 0.00 212 S 8.39 4.73 0.00 3.80 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 0.00 213 K 7.87 4.83 0.00 0.79 0.74 0.00 0.84 0.00 0.00 0.73 0.00 0.00 2.57 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.82 0.88 7.81 214 I 8.70 5.35 1.85 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 1.06 1.67 0.86 0.00 0.00 215 L 9.27 5.11 0.00 1.35 1.07 -0.71 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 216 L 8.78 4.77 0.00 1.37 0.81 0.28 -0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 217 L 9.08 5.23 0.00 1.49 1.55 0.84 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 218 K 9.05 4.42 0.00 1.50 1.54 0.00 1.36 0.00 0.00 1.47 0.00 0.00 2.79 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.19 1.11 7.81 219 D 9.85 4.34 0.00 2.77 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 0.00 220 G 8.28 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 0.00 0.00 0.00 0.00 221 Q 7.96 4.72 0.00 2.18 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.95 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 222 S 8.52 4.62 0.00 3.67 3.71 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 0.00 0.00 0.00 223 I 8.83 4.09 2.03 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 1.51 1.17 1.02 0.00 0.00 224 Q 7.58 4.66 0.00 1.93 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.98 6.84 0.00 0.00 0.00 0.00 0.00 2.31 2.29 0.00 225 Q 7.92 5.74 0.00 2.43 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.14 0.00 0.00 0.00 0.00 0.00 2.24 2.42 0.00 226 G 8.15 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 0.00 227 A 7.85 4.50 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 0.00 228 V 8.49 3.43 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.98 0.00 0.00 229 E 8.14 4.21 0.00 2.25 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 0.00 2.29 2.42 0.00 230 D 7.82 4.53 0.00 2.77 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 0.00 231 I 7.51 4.05 1.74 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.52 0.72 0.00 0.00 232 L 7.40 4.13 0.00 1.20 1.10 -0.16 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 233 T 7.30 4.78 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 1.22 0.00 0.00 234 S 9.01 4.29 0.00 3.91 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 0.00 235 E 8.36 4.09 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 2.39 2.35 0.00 236 N 8.01 4.35 0.00 2.86 2.70 0.00 0.00 7.08 7.58 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 *238 S 8.10 5.24 0.00 4.14 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 239 R 7.97 3.93 0.00 2.00 2.03 0.00 3.19 0.00 0.00 3.16 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.59 0.00 240 F 8.20 4.28 0.00 2.79 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 0.00 241 F 8.02 4.55 0.00 3.17 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 0.00 242 Q 7.88 3.63 0.00 2.22 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.59 0.00 0.00 0.00 0.00 0.00 2.44 2.45 0.00 243 K 7.68 4.61 0.00 1.85 1.66 0.00 1.62 0.00 0.00 1.79 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.68 7.81 244 N 8.81 4.58 0.00 2.74 2.82 0.00 0.00 6.77 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 0.00 245 V 8.60 4.89 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 0.86 0.00 0.00 1.16 0.00 0.00 246 A 9.35 4.83 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 247 V 9.13 4.72 2.23 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 0.99 0.00 0.00 1.00 0.00 0.00 248 Q 9.07 4.71 0.00 2.17 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.57 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 249 R 8.68 4.56 0.00 1.47 1.68 0.00 2.21 0.00 0.00 2.89 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.89 0.00 250 W 8.80 5.06 0.00 3.26 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 0.00 251 N 9.04 3.91 0.00 2.22 2.47 0.00 0.00 7.11 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 252 N 8.26 4.11 0.00 2.78 2.82 0.00 0.00 6.94 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 0.00 253 R 7.57 4.69 0.00 1.86 1.85 0.00 3.40 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 1.65 1.75 0.00 254 F 8.62 5.43 0.00 3.19 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 0.00 255 S 8.90 5.06 0.00 3.90 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 *257 A 8.26 4.34 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *259 L 8.49 4.05 0.00 1.80 1.65 0.94 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.