NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2905 7.8827 121.4541 61.2253 38.7457 173.7795 17 V 4.3849 8.8631 125.9439 61.7907 32.6880 174.4178 18 G 3.8319 8.4120 114.0425 46.4343 0.0000 173.3497 19 G 4.1682 7.7847 110.1365 44.0357 0.0000 172.6686 20 Y 4.9665 7.7513 116.6742 55.0863 42.1971 174.9424 21 T 4.2710 8.6030 117.1021 63.9779 68.4041 175.1948 22 C 4.3204 8.6225 125.5321 60.6205 35.1936 175.0306 23 G 4.0957 8.7124 106.6925 44.1854 0.0000 172.8133 24 A 4.3137 8.5994 125.3106 53.0973 18.5290 176.7822 25 N 4.2549 8.8682 119.2901 54.5632 36.1675 175.2939 26 T 4.2374 7.6588 107.0471 62.6008 69.9641 175.1761 27 V 4.1168 7.0213 121.8308 59.8966 31.4272 173.6070 28 P 4.5391 0.0000 0.0000 64.2219 31.7682 178.1740 29 Y 5.1002 6.8526 115.1480 56.4734 38.7784 174.4811 30 Q 4.6350 7.3412 123.5617 56.2284 29.5372 175.4080 31 V 4.8676 9.0153 119.0383 59.6215 36.1602 174.1923 32 S 4.8857 8.7517 116.8659 56.5595 65.0377 172.6590 33 L 4.5000 8.5940 127.6751 53.4993 43.0598 175.1137 34 N 5.7654 8.9971 122.6534 49.9049 42.1854 174.8945 *37 S 4.1981 8.4223 120.2490 58.3184 64.1376 174.5247 38 G 3.9751 9.8787 108.7486 45.9304 0.0000 172.8024 39 Y 4.5071 6.5989 114.9496 56.2764 39.9078 172.5517 40 H 4.5819 8.8765 121.8744 56.1612 30.4348 174.8308 41 F 5.0551 7.7711 119.5002 56.7984 39.6788 173.8355 42 C 4.7783 6.9182 115.0505 56.1292 44.8313 173.3913 43 G 4.2926 8.5927 109.3050 45.6567 0.0000 172.3166 44 G 4.5854 7.6116 104.1010 46.4911 0.0000 172.7343 45 S 5.4493 8.7120 115.9039 56.3778 66.5748 173.5873 46 L 4.8213 9.2402 127.8230 54.8699 42.2962 177.1217 47 I 4.3823 8.7138 120.2012 61.3407 38.5743 174.5226 48 N 4.7663 7.6453 117.4001 51.9342 39.6544 175.0577 49 S 4.2404 8.6814 112.1170 60.7274 63.1057 174.8129 50 Q 4.5666 9.2032 120.6839 55.1505 30.8692 174.3117 51 W 5.5682 8.4719 117.0749 55.5126 33.3998 174.3736 52 V 4.9610 9.0701 123.0655 61.1598 34.5892 174.1153 53 V 4.9069 8.9089 126.9026 61.7312 33.8577 174.7134 54 S 4.9937 9.0519 120.7133 57.6774 66.2275 172.1718 55 A 4.5287 8.4947 121.1289 50.8010 20.1069 178.4539 56 A 3.8136 8.2967 124.2933 55.3644 18.4390 179.2103 57 H 4.5478 7.9564 108.8536 57.1395 28.6950 175.3647 58 C 4.6790 7.7981 117.2294 57.5878 40.5766 173.4007 59 Y 4.1928 7.7614 122.1931 57.6174 38.8223 175.1484 60 K 3.5950 6.5747 123.1145 56.0873 34.5173 174.5000 61 S 4.2274 8.1974 114.9340 58.3542 64.2457 173.2430 62 G 3.7189 8.2928 106.1843 46.7635 0.0000 173.7223 63 I 4.2364 7.5128 119.8334 60.0029 39.1849 175.1058 64 Q 4.7613 8.8472 128.3283 54.1711 31.5341 174.2113 65 V 4.3167 8.7641 127.4388 62.0780 33.3570 174.6361 66 R 5.0204 8.9547 127.4158 54.6782 32.3693 175.1488 67 L 4.7431 9.0094 124.6432 52.6123 44.9011 177.4957 *69 G 3.9506 8.2384 107.3684 45.4731 0.0000 172.8389 70 E 4.5173 8.2215 118.1887 55.2420 30.6300 174.2091 71 D 4.7676 7.9396 117.0356 55.2951 44.0672 174.3698 72 N 4.7462 8.2558 120.5035 53.0725 39.2582 176.0285 73 I 3.8677 8.5534 120.2302 62.2915 37.9186 176.3432 74 N 4.7253 8.6705 118.0639 53.2220 39.3397 174.9902 75 V 4.3455 7.3117 116.4800 60.6267 34.3189 174.9752 76 V 4.1096 8.4156 126.4830 62.5938 31.1929 175.1911 77 E 4.4500 9.4326 127.1962 55.2146 31.0326 176.7621 78 G 3.9961 8.6505 106.3209 45.9562 0.0000 174.0856 79 N 4.6205 8.9957 117.0381 52.7527 36.8311 174.5283 80 E 4.5864 7.6422 116.7892 56.3752 30.7649 176.4386 81 Q 4.3829 9.0235 120.7549 54.4389 32.8516 173.9926 82 F 5.4949 8.8411 123.3354 56.1190 40.6710 175.4940 83 I 4.7168 8.7770 124.4931 59.4244 41.1627 175.3731 84 S 4.6161 8.6823 122.0300 58.2444 64.3261 173.1090 85 A 4.5265 8.2172 125.6287 51.9314 18.2112 177.9216 86 S 4.4692 9.1174 118.6884 60.4195 64.3890 174.9180 87 K 4.6171 7.5688 117.1982 55.7376 35.5341 174.7406 88 S 5.1890 8.8661 118.5398 57.0257 65.6563 173.6850 89 I 4.4352 9.3813 126.8172 59.4476 38.4414 174.9516 90 V 4.1071 8.2152 127.1145 62.2582 32.6064 175.1371 91 H 3.8982 8.6816 127.3814 56.0125 29.9527 174.3208 92 P 4.2535 0.0000 0.0000 65.5035 31.3533 177.1398 93 S 4.6826 7.9455 111.4904 58.1421 62.8708 173.2777 94 Y 4.4075 8.2318 123.7131 57.6555 39.0480 174.3401 95 N 4.5049 8.3775 125.9540 51.2939 40.0448 175.2762 96 S 3.9709 7.7566 120.5034 60.2368 63.5547 175.6103 97 N 4.3453 8.3636 119.0286 56.1206 38.4103 176.4587 98 T 3.9120 7.8008 105.1726 61.4975 69.6038 175.2309 99 L 3.7900 8.0166 120.8803 55.3354 39.8482 173.9433 100 N 4.5088 7.7479 117.5425 54.5539 39.5652 174.4981 101 N 4.8620 8.6359 118.9492 54.1266 35.9730 175.5453 102 D 4.6081 7.8920 117.4258 52.9398 39.5685 174.7829 103 I 4.7608 7.0346 120.7707 59.2434 42.4152 173.1080 104 M 5.4182 9.2141 127.2488 54.0691 36.1997 173.3002 105 L 5.4131 9.3008 125.2570 53.1892 44.7811 175.3261 106 I 4.9114 9.1691 124.2310 59.4166 40.3794 174.2994 107 K 3.7024 8.6579 129.0534 54.5479 33.5256 175.6242 108 L 4.3200 8.1476 128.0612 54.1317 41.9042 177.1383 109 K 4.1348 8.8031 124.9364 59.1045 32.5933 177.1071 110 S 4.6216 7.7065 111.1562 55.8326 66.1072 173.2288 111 A 4.3781 8.3828 123.2844 52.1136 18.7321 177.3635 112 A 4.3188 9.0103 123.5187 51.8376 19.8003 177.7705 113 S 4.5189 9.1135 117.2204 57.2343 63.3403 174.5101 114 L 4.4665 8.4926 126.0265 54.4691 42.5020 176.6024 115 N 4.8440 9.0260 119.6274 52.3398 39.7438 174.6533 116 S 4.2358 8.8115 111.6462 61.9112 63.0963 175.5356 117 R 4.0978 8.5607 119.6138 56.9452 30.5132 175.9383 118 V 4.6107 7.8527 115.9161 60.9136 33.3796 173.7589 119 A 5.1403 8.4856 128.3282 50.3640 22.9474 175.1116 120 S 5.0723 8.7151 114.0134 57.8001 64.8326 173.1317 121 I 4.4436 8.2015 121.2456 59.2136 39.8098 175.4480 122 S 4.4539 8.3541 123.5613 58.2730 64.1331 173.7859 123 L 4.3950 8.3308 122.9877 53.3330 42.5358 175.2763 124 P 4.5206 0.0000 0.0000 62.9739 32.2609 176.2282 125 T 4.1673 8.2326 108.8205 62.4665 70.0521 174.6255 *127 S 4.7518 7.5644 114.5691 58.0605 64.0441 173.9047 128 C 4.4429 8.3702 117.8426 56.4578 40.7966 173.6815 129 A 4.3161 8.0789 125.2500 51.6473 19.4256 177.3199 130 S 4.3956 8.0821 114.5276 56.5428 65.3803 172.9935 *132 A 4.2488 8.1561 122.6408 53.4080 19.1205 177.1403 133 G 3.9789 9.1111 110.6503 45.3467 0.0000 174.3156 134 T 3.9411 7.4879 117.3036 63.7487 69.4128 173.3093 135 Q 4.5556 8.5851 127.6825 55.7425 30.1926 175.2433 136 C 5.2908 9.3678 122.7688 55.1352 46.5034 172.3118 137 L 5.2164 8.9498 122.4663 53.5491 44.0380 175.0025 138 I 5.3283 9.2122 127.3867 58.8574 39.9722 174.8791 139 S 4.8918 8.5611 119.2393 56.4942 66.4860 173.0406 140 G 3.8080 7.4444 108.6551 46.2071 0.0000 172.9530 141 W 4.6016 8.6776 117.0480 56.2733 29.3813 177.0958 142 G 4.1730 8.3745 109.2377 44.3871 0.0000 173.4838 143 N 3.9664 8.9183 118.6069 54.3103 38.9454 174.6671 144 T 5.0922 8.2403 113.4425 60.6271 69.6331 174.4439 145 K 4.6230 7.8032 121.8021 54.7176 34.7067 176.2827 146 S 4.3259 8.7101 117.6439 60.2059 63.5841 174.3304 147 S 4.5046 8.2800 116.9528 55.5338 62.8023 172.9197 148 G 3.7986 7.4171 110.1990 44.0420 0.0000 170.0933 149 T 4.6155 7.9438 115.7303 61.9843 72.4818 174.3163 150 S 4.2520 9.1478 121.2501 58.0240 65.1770 172.3490 151 Y 4.9609 8.4836 125.9427 55.9344 38.9072 174.4357 152 P 4.6627 0.0000 0.0000 62.5232 32.8759 176.0694 153 D 4.5730 8.7973 118.8957 56.7984 41.3288 177.2285 154 V 5.3319 7.4023 109.7385 58.6490 34.1353 175.8544 155 L 3.1114 8.6146 124.6602 55.0911 43.0207 175.8800 156 K 4.8563 8.1531 125.1260 54.9412 35.0843 174.6159 157 C 5.2781 8.6393 119.3281 55.2306 41.4499 173.0106 158 L 4.8962 8.5507 122.4568 53.9210 45.5968 174.3514 159 K 5.1457 8.9742 125.5611 55.3053 33.5466 175.8240 160 A 4.7974 9.1757 126.1853 49.8603 23.1468 173.3909 161 P 5.0636 0.0000 0.0000 61.6921 34.1334 174.9516 162 I 4.3312 8.2967 122.6705 61.2984 38.0915 175.8641 163 L 4.7729 8.8311 127.6130 53.4188 43.2448 177.0282 164 S 4.3497 8.4446 115.0048 58.1566 63.9622 175.1880 165 D 4.4701 8.7249 122.2348 57.4438 40.4935 179.2899 166 S 4.1552 8.0157 114.5236 61.6827 63.1087 176.6879 167 S 4.1283 7.9197 118.9536 61.1080 62.5741 175.8034 168 C 4.3286 8.2953 121.2268 59.8450 41.7282 175.9307 169 K 3.9817 8.5889 120.1335 59.2270 31.3461 179.6262 170 S 4.2592 7.8643 115.0694 61.3183 62.8107 176.0882 171 A 4.0266 7.9466 122.8456 53.7770 19.6852 177.3635 172 Y 4.9128 7.7624 113.9960 55.0338 38.3022 172.5158 173 P 4.5493 0.0000 0.0000 63.3163 32.2014 177.3048 174 G 3.9913 9.0385 110.2679 46.0927 0.0000 173.6209 175 Q 4.5126 8.1772 117.0994 55.5229 30.4823 175.6039 176 I 4.3320 7.8539 119.3229 60.4821 38.2235 175.6273 177 T 4.5611 8.2868 122.2165 61.7346 70.2131 175.8010 178 S 4.3383 8.5409 116.6107 60.7033 63.2168 174.5600 179 N 5.1354 8.1397 118.4688 53.3580 38.5971 173.7096 180 M 5.5999 7.9240 116.5219 53.9202 36.4149 174.5593 181 F 5.1180 8.7512 114.7667 55.9173 42.0856 172.5170 182 C 5.4395 9.0576 116.9973 55.8780 41.0305 172.5688 183 A 5.0578 9.3473 122.8653 50.3241 22.2705 175.2955 184A G 3.7946 6.9112 109.0281 44.8891 0.0000 172.8411 184 Y 4.6396 8.2305 120.4364 56.0825 41.4560 176.3186 185 L 4.1351 8.6884 125.2484 57.3789 42.0214 178.6537 186 E 4.0370 8.2302 114.9273 56.8174 29.9217 177.4329 187 G 3.8367 7.7431 107.5900 45.3067 0.0000 172.8803 188A G 4.0554 9.6106 105.9813 44.7245 0.0000 173.5750 188 K 5.5544 7.2243 117.1988 53.9619 35.8065 175.2167 189 D 4.6124 8.3578 122.7160 53.9114 44.6929 174.9352 190 S 4.8597 8.8156 117.0156 58.2353 65.2245 172.8981 191 C 4.7441 9.2920 118.5331 55.6465 44.4496 172.2275 192 Q 4.3758 8.6763 118.7277 58.0862 28.4158 178.1324 193 G 4.3191 9.3445 110.9813 45.5071 0.0000 173.6883 194 D 4.7347 8.3825 118.7284 55.1538 41.9256 176.7947 195 S 4.4915 8.0933 115.2899 60.4159 63.5681 175.6081 196 G 4.2549 8.7556 111.9400 46.4460 0.0000 173.8510 197 G 4.3450 7.8432 107.3877 45.3198 0.0000 171.2578 198 P 5.0629 0.0000 0.0000 62.3538 33.4460 175.6315 199 V 4.5995 8.5907 121.6054 61.4005 33.9333 173.8140 200 V 4.7381 8.6170 128.7030 61.2635 33.7563 173.6905 201 C 5.1080 8.7943 125.0420 55.5549 43.6161 174.6075 202 S 3.5397 9.7686 120.3210 59.7437 60.0476 173.3337 203 G 3.9113 8.4979 104.8401 45.6104 0.0000 173.9895 204 K 4.6668 7.5571 118.1698 53.1268 34.8782 175.4593 *209 L 4.2308 8.2593 123.1932 55.4027 42.1010 175.7289 210 Q 4.4722 8.9200 126.1969 56.8803 30.7444 175.8685 211 G 5.3087 8.0031 104.4488 45.8158 0.0000 171.4790 212 I 5.2498 8.1895 119.6819 58.8460 40.9635 175.4712 213 V 3.7972 8.8986 127.4251 64.0428 31.8502 174.2422 214 S 4.8173 8.4280 120.8634 58.4966 64.1247 173.8795 215 W 5.0822 7.5865 113.9903 55.4376 32.0841 172.5567 216 G 3.9859 8.3827 105.9228 46.2237 0.0000 173.5685 217 S 4.5901 8.4944 116.1128 56.8899 62.0937 173.0593 *219 G 4.2076 7.9734 118.1691 45.6596 0.0000 170.7175 220 C 4.9271 8.1437 115.4521 56.5038 45.3254 173.8542 221A A 3.9756 9.2305 126.1071 53.1861 16.8343 176.9060 221 Q 4.5934 7.3429 117.6235 56.1287 29.8270 175.9228 222 K 4.2419 8.4932 122.2192 58.0856 32.5987 176.1430 223 N 4.2819 9.3741 121.9051 54.0672 36.8737 175.2916 224 K 4.3092 7.6577 117.2860 53.7086 32.3597 173.9650 225 P 4.6270 0.0000 0.0000 61.9389 33.2211 177.1859 226 G 3.6180 8.4396 106.3437 46.1695 0.0000 172.6972 227 V 4.4112 7.7124 122.7300 60.7225 33.8445 174.1504 228 Y 4.8596 8.3469 124.3751 55.9908 42.2686 174.8881 229 T 4.4026 8.4529 119.2990 63.5208 70.0028 174.4545 230 K 5.0418 9.2710 128.3243 55.3759 31.4624 177.1054 231 V 3.9199 8.7722 126.4426 65.9760 31.3604 174.9461 232 C 4.4589 8.3415 112.6030 58.4066 41.4640 174.9403 233 N 4.2206 8.1041 117.1546 54.5697 38.4753 175.5750 234 Y 4.8025 8.0738 117.7081 57.3919 38.8291 177.2387 235 V 3.6908 7.9131 121.2766 66.3176 31.4816 177.9969 236 S 4.1197 8.0938 114.1904 61.3108 62.7025 176.2638 237 W 4.1520 8.3154 130.4775 60.5148 30.4911 177.7148 238 I 3.2579 8.4400 120.0754 64.3027 36.6166 178.5381 239 K 3.7549 8.0515 119.1036 59.6397 31.4181 179.5321 240 Q 3.9072 8.2178 118.5533 59.0830 28.3275 179.0444 241 T 3.5682 7.3500 116.2010 66.4536 68.6906 176.6281 242 I 2.7229 7.2264 121.5843 63.9032 36.7446 178.3352 243 A 4.0141 7.6791 120.7479 54.2551 18.1594 178.7772 244 S 4.6526 7.2672 109.3667 58.2389 63.5174 174.1086 245 N 4.6796 8.0657 125.5346 53.9049 39.3113 174.0424 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 16 I 7.88 4.29 1.81 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 1.36 0.87 0.87 0.00 0.00 17 V 8.86 4.38 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 1.03 0.00 0.00 0.99 0.00 0.00 18 G 8.41 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 0.00 0.00 0.00 19 G 7.78 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 0.00 0.00 0.00 0.00 20 Y 7.75 4.97 0.00 2.95 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 21 T 8.60 4.27 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 1.23 0.00 0.00 22 C 8.62 4.32 0.00 2.76 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 23 G 8.71 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.60 4.31 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 25 N 8.87 4.25 0.00 2.89 2.91 0.00 0.00 7.14 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 T 7.66 4.24 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 1.22 0.00 0.00 27 V 7.02 4.12 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 0.36 0.00 0.00 0.76 0.00 0.00 28 P 0.00 4.54 0.00 2.39 2.31 0.00 3.78 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 2.20 1.98 0.00 29 Y 6.85 5.10 0.00 3.27 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 30 Q 7.34 4.63 0.00 1.81 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.73 0.00 0.00 0.00 0.00 0.00 1.92 2.51 0.00 31 V 9.02 4.87 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 0.79 0.00 0.00 0.98 0.00 0.00 32 S 8.75 4.89 0.00 3.02 3.29 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 33 L 8.59 4.50 0.00 0.49 0.86 0.76 0.25 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 34 N 9.00 5.77 0.00 2.38 2.42 0.00 0.00 6.78 7.74 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 *37 S 8.42 4.20 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 38 G 9.88 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 39 Y 6.60 4.51 0.00 3.03 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 40 H 8.88 4.58 0.00 2.84 3.15 0.00 5.86 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.77 5.06 0.00 3.07 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 C 6.92 4.78 0.00 2.21 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 43 G 8.59 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 0.00 0.00 0.00 0.00 44 G 7.61 4.59 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 0.00 45 S 8.71 5.45 0.00 3.82 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 9.24 4.82 0.00 1.87 1.68 1.08 0.97 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 47 I 8.71 4.38 1.90 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.89 0.96 0.00 0.00 48 N 7.65 4.77 0.00 3.00 3.00 0.00 0.00 6.02 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.68 4.24 0.00 4.21 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Q 9.20 4.57 0.00 2.07 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.79 0.00 0.00 0.00 0.00 0.00 1.91 2.15 0.00 51 W 8.47 5.57 0.00 3.36 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 52 V 9.07 4.96 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.98 0.00 0.00 53 V 8.91 4.91 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 1.04 0.00 0.00 1.02 0.00 0.00 54 S 9.05 4.99 0.00 3.89 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.49 4.53 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 A 8.30 3.81 0.34 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 57 H 7.96 4.55 0.00 3.39 3.54 0.00 5.55 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.80 4.68 0.00 3.21 3.29 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 59 Y 7.76 4.19 0.00 3.01 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 K 6.57 3.59 0.00 1.50 1.35 0.00 0.89 0.00 0.00 1.32 0.00 0.00 2.45 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.79 0.97 7.81 61 S 8.20 4.23 0.00 3.93 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.29 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 63 I 7.51 4.24 1.84 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.20 0.88 0.00 0.00 64 Q 8.85 4.76 0.00 1.97 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.91 0.00 0.00 0.00 0.00 0.00 2.03 2.18 0.00 65 V 8.76 4.32 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.88 0.00 0.00 66 R 8.95 5.02 0.00 1.51 1.73 0.00 2.65 0.00 0.00 2.62 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 1.15 0.00 67 L 9.01 4.74 0.00 1.67 1.63 1.03 0.93 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 *69 G 8.24 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 70 E 8.22 4.52 0.00 2.11 1.91 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 2.35 2.08 0.00 71 D 7.94 4.77 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 72 N 8.26 4.75 0.00 2.87 2.86 0.00 0.00 7.20 7.52 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 73 I 8.55 3.87 1.45 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.55 -0.37 0.00 0.00 74 N 8.67 4.73 0.00 2.82 2.90 0.00 0.00 6.64 7.27 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 75 V 7.31 4.35 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 0.78 0.00 0.00 0.95 0.00 0.00 76 V 8.42 4.11 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 0.82 0.00 0.00 0.95 0.00 0.00 77 E 9.43 4.45 0.00 1.95 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.43 0.00 78 G 8.65 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 N 9.00 4.62 0.00 2.93 3.14 0.00 0.00 6.96 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 E 7.64 4.59 0.00 1.59 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 0.00 2.70 2.45 0.00 81 Q 9.02 4.38 0.00 1.99 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.78 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 82 F 8.84 5.49 0.00 2.80 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 I 8.78 4.72 1.87 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 1.24 0.81 0.94 0.00 0.00 84 S 8.68 4.62 0.00 3.75 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 A 8.22 4.53 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 86 S 9.12 4.47 0.00 3.76 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 87 K 7.57 4.62 0.00 1.84 1.88 0.00 1.42 0.00 0.00 1.85 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.23 1.44 7.81 88 S 8.87 5.19 0.00 4.11 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 89 I 9.38 4.44 2.07 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.02 1.07 0.00 0.00 90 V 8.22 4.11 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.76 0.00 0.00 91 H 8.68 3.90 0.00 2.88 3.06 0.00 5.66 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 92 P 0.00 4.25 0.00 2.08 2.16 0.00 3.28 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.24 0.00 93 S 7.95 4.68 0.00 3.93 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 8.23 4.41 0.00 3.06 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 N 8.38 4.50 0.00 2.59 2.47 0.00 0.00 6.61 7.09 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 96 S 7.76 3.97 0.00 3.92 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 97 N 8.36 4.35 0.00 2.75 2.79 0.00 0.00 6.96 8.23 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 98 T 7.80 3.91 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 99 L 8.02 3.79 0.00 1.48 1.82 0.23 0.91 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 0.00 100 N 7.75 4.51 0.00 2.74 2.66 0.00 0.00 7.23 7.83 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 0.00 101 N 8.64 4.86 0.00 3.04 2.60 0.00 0.00 7.22 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 D 7.89 4.61 0.00 3.04 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 0.00 103 I 7.03 4.76 1.39 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 1.29 1.18 0.06 0.00 0.00 104 M 9.21 5.42 0.00 2.24 1.83 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.63 0.00 105 L 9.30 5.41 0.00 1.81 1.91 0.26 0.87 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 0.00 106 I 9.17 4.91 1.92 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.84 0.88 0.00 0.00 107 K 8.66 3.70 0.00 0.79 1.09 0.00 1.34 0.00 0.00 1.35 0.00 0.00 2.62 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.68 0.21 7.81 108 L 8.15 4.32 0.00 1.46 1.57 0.95 0.69 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 0.00 109 K 8.80 4.13 0.00 1.84 1.80 0.00 1.72 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.36 7.81 110 S 7.71 4.62 0.00 3.93 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 A 8.38 4.38 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 A 9.01 4.32 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 S 9.11 4.52 0.00 3.74 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 L 8.49 4.47 0.00 1.64 1.63 0.96 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 115 N 9.03 4.84 0.00 2.86 2.92 0.00 0.00 6.47 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 0.00 116 S 8.81 4.24 0.00 4.01 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 0.00 117 R 8.56 4.10 0.00 2.07 2.03 0.00 3.12 0.00 0.00 3.10 7.39 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.56 4.75 0.00 4.00 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 0.00 128 C 8.37 4.44 0.00 2.94 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 8.08 4.32 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.08 4.40 0.00 3.98 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 *132 A 8.16 4.25 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 G 9.11 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 0.00 134 T 7.49 3.94 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 1.14 0.00 0.00 135 Q 8.59 4.56 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.47 0.00 136 C 9.37 5.29 0.00 2.78 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 0.00 137 L 8.95 5.22 0.00 1.76 1.56 1.01 1.09 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 0.00 138 I 9.21 5.33 1.88 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 1.42 0.98 0.00 0.00 139 S 8.56 4.89 0.00 3.54 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 G 7.44 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 W 8.68 4.60 0.00 3.08 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 G 8.37 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 0.00 0.00 0.00 0.00 143 N 8.92 3.97 0.00 2.33 2.67 0.00 0.00 7.14 7.38 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 0.00 144 T 8.24 5.09 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 1.29 0.00 0.00 145 K 7.80 4.62 0.00 1.65 1.69 0.00 1.69 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.29 1.32 7.81 146 S 8.71 4.33 0.00 4.24 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 S 8.28 4.50 0.00 3.83 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 0.00 148 G 7.42 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 0.00 149 T 7.94 4.62 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 1.13 0.00 0.00 150 S 9.15 4.25 0.00 3.78 3.61 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 0.00 151 Y 8.48 4.96 0.00 2.99 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 0.00 152 P 0.00 4.66 0.00 2.46 2.11 0.00 4.18 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.06 0.00 153 D 8.80 4.57 0.00 2.80 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 0.00 154 V 7.40 5.33 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 1.09 0.00 0.00 0.97 0.00 0.00 155 L 8.61 3.11 0.00 1.25 1.26 -0.61 -0.06 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 0.00 156 K 8.15 4.86 0.00 1.68 1.50 0.00 1.61 0.00 0.00 1.55 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.48 7.81 157 C 8.64 5.28 0.00 1.49 2.25 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 0.00 158 L 8.55 4.90 0.00 1.68 1.45 1.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 159 K 8.97 5.15 0.00 1.82 1.82 0.00 1.85 0.00 0.00 1.77 0.00 0.00 2.81 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.50 1.67 7.81 160 A 9.18 4.80 1.17 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 0.00 0.00 161 P 0.00 5.06 0.00 2.02 2.08 0.00 3.11 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 1.83 1.74 0.00 162 I 8.30 4.33 1.86 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.33 0.74 0.00 0.00 163 L 8.83 4.77 0.00 1.54 1.60 0.93 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.44 4.35 0.00 4.00 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 0.00 165 D 8.72 4.47 0.00 2.73 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 S 8.02 4.16 0.00 4.06 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 S 7.92 4.13 0.00 3.97 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 C 8.30 4.33 0.00 3.19 3.33 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 0.00 169 K 8.59 3.98 0.00 1.91 1.90 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.68 7.81 170 S 7.86 4.26 0.00 4.01 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 0.00 171 A 7.95 4.03 1.12 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 0.00 0.00 172 Y 7.76 4.91 0.00 3.15 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 0.00 173 P 0.00 4.55 0.00 2.09 2.06 0.00 3.90 0.00 0.00 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.19 0.00 174 G 9.04 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 0.00 175 Q 8.18 4.51 0.00 2.48 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.73 6.68 0.00 0.00 0.00 0.00 0.00 2.29 2.58 0.00 176 I 7.85 4.33 1.99 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.93 1.00 0.00 0.00 177 T 8.29 4.56 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 1.25 0.00 0.00 178 S 8.54 4.34 0.00 3.98 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 0.00 179 N 8.14 5.14 0.00 2.90 3.10 0.00 0.00 6.89 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 0.00 180 M 7.92 5.60 0.00 1.89 2.09 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.61 0.00 181 F 8.75 5.12 0.00 3.07 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 C 9.06 5.44 0.00 2.99 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 A 9.35 5.06 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184A G 6.91 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 0.00 0.00 0.00 184 Y 8.23 4.64 0.00 3.08 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 0.00 185 L 8.69 4.14 0.00 1.74 1.73 0.92 0.88 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 0.00 186 E 8.23 4.04 0.00 2.10 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 0.00 2.31 2.26 0.00 187 G 7.74 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 188A G 9.61 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 0.00 0.00 0.00 188 K 7.22 5.55 0.00 1.47 1.70 0.00 1.36 0.00 0.00 2.11 0.00 0.00 2.23 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.38 1.02 7.81 189 D 8.36 4.61 0.00 2.83 2.54 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 0.00 190 S 8.82 4.86 0.00 4.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 C 9.29 4.74 0.00 2.95 3.12 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 0.00 192 Q 8.68 4.38 0.00 2.33 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.20 0.00 0.00 0.00 0.00 0.00 2.56 2.55 0.00 193 G 9.34 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 0.00 0.00 0.00 0.00 194 D 8.38 4.73 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 0.00 195 S 8.09 4.49 0.00 3.99 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 0.00 196 G 8.76 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 G 7.84 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 0.00 198 P 0.00 5.06 0.00 2.34 2.38 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 2.21 2.22 0.00 199 V 8.59 4.60 2.25 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 0.93 0.00 0.00 0.57 0.00 0.00 200 V 8.62 4.74 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 0.89 0.00 0.00 0.68 0.00 0.00 201 C 8.79 5.11 0.00 2.79 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 S 9.77 3.54 0.00 3.96 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 0.00 203 G 8.50 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 K 7.56 4.67 0.00 1.96 1.64 0.00 1.56 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.30 1.44 7.81 *209 L 8.26 4.23 0.00 1.51 1.65 1.03 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 210 Q 8.92 4.47 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.38 0.00 0.00 0.00 0.00 0.00 2.42 2.34 0.00 211 G 8.00 5.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 I 8.19 5.25 1.91 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 1.06 0.92 0.00 0.00 213 V 8.90 3.80 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 1.17 0.00 0.00 214 S 8.43 4.82 0.00 3.88 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 W 7.59 5.08 0.00 3.36 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 G 8.38 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 0.00 217 S 8.49 4.59 0.00 4.32 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 *219 G 7.97 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 C 8.14 4.93 0.00 2.95 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 221A A 9.23 3.98 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 0.00 221 Q 7.34 4.59 0.00 2.22 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.93 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 222 K 8.49 4.24 0.00 1.70 1.73 0.00 2.13 0.00 0.00 1.71 0.00 0.00 3.09 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.53 7.81 223 N 9.37 4.28 0.00 2.82 2.81 0.00 0.00 6.80 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 0.00 224 K 7.66 4.31 0.00 1.75 1.78 0.00 1.60 0.00 0.00 1.33 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.49 7.81 225 P 0.00 4.63 0.00 2.14 2.10 0.00 3.62 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.00 0.00 226 G 8.44 3.62 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 0.00 0.00 0.00 227 V 7.71 4.41 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 0.39 0.00 0.00 -0.77 0.00 0.00 228 Y 8.35 4.86 0.00 1.43 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 T 8.45 4.40 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 1.19 0.00 0.00 230 K 9.27 5.04 0.00 2.13 1.93 0.00 1.83 0.00 0.00 1.93 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.54 1.66 7.81 231 V 8.77 3.92 2.43 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 1.15 0.00 0.00 1.09 0.00 0.00 232 C 8.34 4.46 0.00 3.17 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 N 8.10 4.22 0.00 2.49 2.35 0.00 0.00 6.82 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 0.00 234 Y 8.07 4.80 0.00 3.17 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 0.00 235 V 7.91 3.69 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 1.16 0.00 0.00 1.08 0.00 0.00 236 S 8.09 4.12 0.00 3.98 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 W 8.32 4.15 0.00 3.52 3.62 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 0.00 238 I 8.44 3.26 2.04 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 1.70 1.00 0.78 0.00 0.00 239 K 8.05 3.75 0.00 1.93 1.77 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.49 7.81 240 Q 8.22 3.91 0.00 1.99 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.82 0.00 0.00 0.00 0.00 0.00 2.33 2.54 0.00 241 T 7.35 3.57 3.44 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 0.76 0.00 0.00 242 I 7.23 2.72 1.33 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.02 0.33 0.00 0.00 243 A 7.68 4.01 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 244 S 7.27 4.65 0.00 4.02 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 0.00 245 N 8.07 4.68 0.00 3.08 3.05 0.00 0.00 6.74 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 * Residues marked with a * may have inaccurate shift predictions.