NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2548 7.8827 121.4369 61.1743 38.8259 173.9381 17 V 4.2422 8.3304 124.2131 61.5811 33.5230 174.3022 18 G 3.7144 8.9002 112.9821 46.3783 0.0000 173.2323 19 G 4.2827 7.7115 107.5457 44.8788 0.0000 171.9036 20 Y 5.0586 8.0484 117.5967 55.1248 42.2420 174.5227 21 T 4.3669 8.5464 116.1567 63.3447 68.5310 175.8090 22 C 4.2442 8.6157 125.3091 60.8145 40.5031 173.8818 23 G 3.7179 7.7989 102.2224 43.3134 0.0000 172.6030 24 A 4.2871 8.4320 122.1137 53.1759 19.7214 178.1835 25 N 4.0067 8.3420 118.7573 54.7872 35.8707 175.2209 26 T 4.3335 7.5010 114.0111 62.3928 69.6892 174.3813 27 V 4.0265 7.0694 120.5709 60.3316 31.1622 173.7226 28 P 4.4928 0.0000 0.0000 63.9723 32.1433 177.8654 29 Y 5.1323 6.5914 116.2724 56.3183 38.7150 174.7333 30 Q 4.6113 7.3627 123.1582 56.2767 29.7238 175.1992 31 V 4.8547 8.7346 124.8212 61.1809 35.7558 173.7620 32 S 4.9281 8.7826 119.4056 56.4311 65.2789 172.4833 33 L 4.8454 8.5323 127.0276 53.0559 43.5527 174.8726 34 N 5.9952 9.2402 122.9720 50.0672 41.9206 174.9489 *37 S 4.4196 8.3792 120.7088 58.4448 64.1704 173.8212 38 G 4.0363 8.9995 109.3868 46.9613 0.0000 172.8651 39 Y 4.6703 6.4887 115.5046 55.8359 40.7087 172.7952 40 H 4.8266 8.7382 120.7023 55.7568 30.3708 174.3846 41 F 5.1182 8.3015 120.7085 57.3180 40.1571 173.8805 42 C 4.8909 6.8049 115.0405 56.1251 41.7346 172.6630 43 G 4.4046 8.8015 108.0526 45.2080 0.0000 172.0386 44 G 4.5035 8.1989 105.7395 46.2973 0.0000 172.4792 45 S 5.4239 8.8223 115.0908 56.5141 67.0315 173.6381 46 L 4.8429 9.2322 127.5470 54.6872 42.6481 177.0792 47 I 4.5055 8.4036 119.1184 60.6363 39.1721 174.7242 48 N 4.3850 7.9030 117.3746 52.1080 39.1925 175.1243 49 S 4.1401 8.3128 113.5900 61.1778 62.8789 175.8905 50 Q 4.4810 8.1756 116.6390 55.0751 30.0540 174.5252 51 W 5.4599 8.1298 117.6652 54.7325 33.3940 174.4899 52 V 5.0968 9.2112 122.5489 61.1171 34.7030 174.4522 53 V 4.9544 8.7290 126.3616 60.5252 34.3014 174.9276 54 S 5.0781 8.7263 116.1742 57.7947 66.0731 172.1551 55 A 4.9486 8.7397 119.9648 50.0334 20.3845 178.5638 56 A 3.8858 8.1461 123.6920 54.8194 18.5389 178.8210 57 H 4.7457 8.0691 109.9448 56.2783 28.6107 175.2153 58 C 4.8901 7.7551 116.3757 56.9973 40.7617 173.4826 59 Y 4.3188 7.5858 121.7075 57.8335 38.8171 175.2393 60 K 3.8885 7.2134 123.8297 55.3503 36.1130 174.8881 61 S 4.3853 7.8941 115.1324 57.7559 64.3072 173.2418 62 G 3.6760 8.3331 109.8298 46.5382 0.0000 173.8329 63 I 4.4476 7.3124 118.9343 60.1605 39.5862 175.9751 64 Q 4.8446 8.8168 126.8024 54.2310 32.2586 174.0004 65 V 4.7524 8.9153 126.0011 61.2422 34.2399 174.3784 66 R 5.2355 8.6718 126.2624 54.5707 33.0145 174.9881 67 L 4.8417 9.2845 124.1688 52.3984 45.3376 176.6698 *69 G 4.1491 8.2418 105.0465 46.4130 0.0000 172.6449 70 E 4.8894 8.5070 118.6217 54.8339 31.0554 174.6428 71 D 4.8263 8.6441 120.1178 55.3003 43.5399 174.8851 72 N 5.4301 8.2340 119.7703 51.9768 39.4297 175.5092 73 I 3.8207 8.5227 119.6192 62.1621 37.7693 176.1728 74 N 4.8298 8.9098 117.9974 52.9584 39.1804 174.4951 75 V 4.3154 7.4615 118.4946 60.8549 34.1730 174.7542 76 V 4.2763 8.5181 127.1839 62.4025 31.7010 175.3682 77 E 4.5557 9.0962 128.6799 56.1853 29.8381 176.9438 78 G 3.8826 8.3057 104.4530 46.4785 0.0000 174.3599 79 N 4.8967 7.9163 114.0551 52.8748 39.4376 174.4729 80 E 4.8395 7.8716 118.3659 55.1122 32.2429 175.2788 81 Q 4.3877 8.6110 118.9753 54.2481 32.5116 174.5380 82 F 5.6338 8.8698 122.9133 56.0503 40.9354 175.0012 83 I 4.7002 9.1442 124.9456 59.5103 40.9716 175.6105 84 S 4.9543 8.5872 121.2975 57.6393 64.7569 173.3451 85 A 4.5787 8.3539 124.4632 52.1512 18.4911 177.6642 86 S 4.6216 8.7300 115.7463 59.7120 64.7849 174.3331 87 K 4.7059 7.4802 117.0059 55.8599 35.6985 174.9273 88 S 5.3147 8.6640 115.9788 56.9721 67.0349 173.7028 89 I 4.6399 9.1633 123.8726 59.7143 40.3254 174.6333 90 V 4.4952 8.4398 127.1221 61.2804 33.2459 174.9444 91 H 3.6032 8.6068 126.9389 55.8770 30.0186 174.0410 92 P 4.1587 0.0000 0.0000 65.9284 30.8477 176.9942 93 S 4.6209 7.7333 111.6674 57.9242 63.0461 173.2093 94 Y 4.2716 8.0810 123.7316 57.8942 38.9015 174.5282 95 N 4.5970 8.4279 126.3108 51.5118 39.5779 175.1180 96 S 4.0510 7.7089 119.8366 59.2305 63.7437 175.1382 97 N 4.3918 8.2012 119.2391 55.8512 38.6091 176.3564 98 T 3.9177 7.7111 105.1469 61.0925 69.7199 174.8029 99 L 3.7995 7.6614 120.7861 55.6385 39.6856 173.8415 100 N 4.5609 7.8610 116.7478 54.3480 39.7953 174.2948 101 N 5.0514 8.6747 119.7490 54.2513 36.0195 175.5565 102 D 4.6099 7.7613 118.1548 53.0430 40.2027 174.3254 103 I 4.9010 7.1502 121.0253 59.3176 42.4641 172.9077 104 M 5.4430 8.9778 126.0350 54.3362 36.3620 173.1572 105 L 5.4961 9.5269 123.7299 53.0809 45.2123 175.4761 106 I 5.0463 9.1392 123.6867 59.4850 40.4613 174.3978 107 K 3.8407 8.6398 128.5578 54.6484 33.8418 175.3122 108 L 4.5515 8.0723 126.7969 53.6278 42.5728 176.9236 109 K 4.0512 8.7789 124.5872 59.2277 32.3833 177.1486 110 S 4.7520 7.7934 112.4428 56.0561 66.3338 173.3650 111 A 4.4610 8.2672 123.4708 51.8694 18.9309 177.4467 112 A 4.3740 8.4886 122.9111 51.7368 20.0805 177.1965 113 S 4.6652 9.0827 116.2719 56.8987 64.0448 174.6159 114 L 4.5408 8.5425 125.7977 54.3100 42.8964 176.4489 115 N 4.7908 8.7728 119.5980 52.5126 39.3371 175.1395 116 S 4.2697 8.7889 112.2428 61.9039 63.1454 175.4814 117 R 4.3022 8.5387 117.8400 56.3744 30.4516 176.4984 118 V 4.4332 7.8883 115.5841 60.9524 33.5009 173.6767 119 A 5.2598 8.6483 128.5581 50.2311 22.9884 174.6878 120 S 5.1810 8.6726 113.5675 57.1945 65.4540 173.0819 121 I 4.4108 8.2040 120.5139 59.3352 39.9806 175.1785 122 S 4.5968 8.3190 122.3196 57.4760 64.1187 174.1838 123 L 4.4253 8.0656 122.9162 53.2683 42.6183 175.1532 124 P 4.6015 0.0000 0.0000 62.7038 32.7217 176.0248 125 T 4.1530 8.2023 108.4244 62.4900 70.0628 174.6129 *127 S 4.9700 7.5565 114.3900 58.1595 64.0471 173.6295 128 C 4.5088 8.3619 117.4117 56.1936 40.9857 173.4890 129 A 4.4959 7.2594 125.3400 51.2522 19.9234 177.8483 130 S 4.2371 8.0829 115.9507 57.7348 64.1533 173.5745 *132 A 4.1778 8.1910 124.3768 53.4361 19.5150 175.7395 133 G 4.2764 9.1172 113.3933 46.3994 0.0000 174.9482 134 T 3.8812 7.4499 116.3846 64.0360 69.6849 172.9648 135 Q 4.6964 8.5318 123.6737 55.0456 30.2075 175.6849 136 C 5.3050 9.3442 120.5499 54.9644 45.9261 172.4224 137 L 5.2555 8.9117 122.4124 53.4466 44.5330 174.9993 138 I 5.3207 9.0646 127.1035 58.7558 39.8944 174.8509 139 S 4.9387 9.2756 119.9925 55.9716 66.7347 173.1154 140 G 3.7923 6.9276 107.9967 46.0192 0.0000 172.7614 141 W 4.5254 8.5213 117.2673 56.2183 29.5896 176.7861 142 G 3.9261 8.5448 108.7165 44.0586 0.0000 173.4261 143 N 3.5535 7.5207 117.9727 53.8908 39.1268 174.3932 144 T 5.1311 8.1741 110.9491 60.1493 69.8566 173.7598 145 K 4.5223 7.9727 121.9779 54.7681 34.2049 175.8197 146 S 4.1753 8.8522 119.2520 61.2318 62.6365 175.3656 147 S 4.5418 9.1820 119.7842 55.2878 61.5251 174.6001 148 G 3.9849 7.0443 110.4766 44.5322 0.0000 169.3391 149 T 4.9265 7.8128 115.8316 62.0494 72.4478 174.0249 150 S 4.6668 9.6036 120.3884 57.4382 66.5266 172.2600 151 Y 4.8072 8.7456 124.8873 55.4801 39.9510 174.0696 152 P 4.6870 0.0000 0.0000 62.6534 32.7096 175.3574 153 D 5.0939 8.6509 115.3081 54.0119 43.3520 176.4145 154 V 5.5332 7.7725 110.6894 58.4230 34.7315 175.3349 155 L 3.2899 8.3434 124.4868 54.8831 43.2604 175.6453 156 K 4.8477 8.1827 124.7432 54.7444 35.4393 174.5267 157 C 5.2703 8.6166 120.3391 55.1720 44.0389 172.9443 158 L 4.9115 8.3557 122.2423 54.0043 45.5522 174.3155 159 K 5.0781 8.9853 125.8007 55.2355 33.5076 175.8227 160 A 4.9838 9.4127 126.3488 49.0424 23.2191 173.5585 161 P 5.0256 0.0000 0.0000 61.9522 33.9843 175.0048 162 I 4.2932 8.3567 121.9463 61.1644 38.2579 176.0620 163 L 4.8795 8.6383 127.2327 53.1895 43.6150 176.6935 164 S 4.4033 8.1830 113.7373 58.0442 64.0418 175.2895 165 D 4.4519 8.7657 122.3797 57.5622 40.5664 179.2789 166 S 4.1765 8.0467 114.6199 61.5634 63.2494 176.6432 167 S 4.2628 8.0866 119.2203 60.1809 62.8016 175.8017 168 C 4.3554 8.1698 122.4729 59.7654 43.3405 175.7492 169 K 3.9879 8.4526 118.9894 59.1226 31.5056 179.2271 170 S 4.2807 8.2933 114.6614 61.0308 62.8008 176.4097 171 A 3.8611 7.4135 122.9273 53.6259 19.6868 177.2544 172 Y 4.8880 7.6316 113.6971 55.4153 38.2032 172.8392 173 P 4.5935 0.0000 0.0000 63.7826 32.3470 177.1799 174 G 4.0008 9.0477 110.0518 46.2152 0.0000 173.8039 175 Q 4.5856 8.2163 117.4237 55.3082 30.9000 175.7920 176 I 4.4547 7.8524 118.8720 60.0953 38.7531 174.9538 177 T 4.6964 8.1448 114.1568 59.4109 71.2895 174.8270 178 S 4.3417 8.5635 114.7968 60.4374 63.2289 174.3957 179 N 4.9328 8.0648 118.9860 53.4011 38.4932 173.9063 180 M 5.5793 7.9689 117.2638 53.7156 36.1032 174.4055 181 F 5.1566 8.6460 115.1344 55.8356 42.3435 172.3921 182 C 5.9681 9.2921 114.9951 54.5596 39.6911 173.0563 183 A 4.9799 8.9386 121.5748 51.2640 22.3740 175.4404 184A G 3.8359 6.7922 105.4792 44.6267 0.0000 172.7199 184 Y 4.6581 8.4255 118.0142 56.2195 41.6385 176.3350 185 L 4.2170 8.5270 122.8574 56.6715 42.2476 178.4494 186 E 4.0884 8.2071 115.2421 56.9521 30.0284 177.9406 187 G 3.6937 7.3326 108.2510 44.9502 0.0000 171.8456 188A G 4.3642 8.7916 114.3406 44.6037 0.0000 173.5143 188 K 4.7988 7.0342 118.9020 53.6928 35.5132 174.3850 189 D 4.5888 8.2690 122.4864 53.9952 45.7373 175.3780 190 S 4.6632 8.7973 116.7664 58.3977 64.8695 172.9749 191 C 4.7364 9.1185 118.7382 55.4509 47.9330 172.4579 192 Q 4.2555 8.5427 119.1066 58.0990 29.0382 177.1639 193 G 4.5060 9.2691 117.1336 46.3444 0.0000 175.3239 194 D 4.6381 7.9632 119.1396 55.1250 41.2448 177.0583 195 S 4.4773 7.8302 116.3868 60.5235 63.4496 175.2261 196 G 4.1180 8.6854 112.6011 46.4392 0.0000 173.8814 197 G 4.2598 7.8436 107.0021 45.1933 0.0000 171.5931 198 P 5.1317 0.0000 0.0000 62.5550 33.5480 175.7254 199 V 4.6057 8.4658 120.5071 61.5394 34.5534 174.0085 200 V 4.9457 8.8476 128.6584 61.2347 34.3055 173.6108 201 C 5.1123 8.7661 124.3376 55.7955 44.0021 174.5566 202 S 3.5964 9.8232 119.5328 59.7125 60.1807 173.1973 203 G 3.8993 8.3977 103.9298 45.7526 0.0000 173.8442 204 K 4.3863 7.8184 118.6305 54.0124 35.2240 175.5263 *209 L 4.3244 8.2269 122.0742 55.5103 42.1883 175.8570 210 Q 4.6021 8.5520 125.2070 56.2929 31.3357 175.6326 211 G 5.3679 8.5525 104.9962 45.6856 0.0000 171.5885 212 I 5.0937 8.1746 119.5503 58.8962 41.2521 175.3710 213 V 3.9294 8.9852 127.6191 63.8243 31.8954 174.4252 214 S 4.6891 8.4560 120.5531 58.9524 64.3641 173.4153 215 W 4.9139 7.1910 114.1618 56.2822 31.8308 171.9708 216 G 3.7317 8.1423 105.5224 46.7378 0.0000 172.8828 217 S 4.7339 8.3709 114.7760 56.5424 63.0393 172.5247 *219 G 4.4495 8.0038 119.3123 45.5682 0.0000 171.3496 220 C 4.9570 8.4536 118.6549 56.1783 44.0513 173.8647 221A A 3.8271 8.6891 121.7817 53.3843 16.5666 177.2980 221 Q 4.5876 7.4739 121.8082 56.0666 29.9750 175.9458 222 K 4.3950 8.3144 121.0192 57.8356 32.6832 176.6251 223 N 4.2927 9.3330 121.7372 53.7727 36.7930 175.1734 224 K 4.3038 7.5535 118.2636 53.5316 32.2375 173.9560 225 P 4.6343 0.0000 0.0000 61.9909 33.2133 176.3558 226 G 3.7990 8.4454 107.3559 44.9474 0.0000 172.7632 227 V 4.3898 7.6722 120.7560 60.7187 34.0078 174.1401 228 Y 4.9533 8.1081 124.3990 56.0226 41.9685 174.9911 229 T 4.4004 8.4962 119.3318 63.5362 70.2117 174.4282 230 K 5.1453 9.2753 128.0355 55.2463 31.4894 177.1317 231 V 3.9669 8.7680 126.4670 65.8694 31.3751 174.8484 232 C 4.3160 8.3975 112.6124 58.1181 41.4256 174.6594 233 N 4.3584 7.9308 116.5277 54.0022 38.6268 174.8945 234 Y 4.8414 7.9409 117.5408 57.3460 39.5568 177.5074 235 V 3.6741 8.0926 121.4363 66.4235 31.5080 178.1139 236 S 4.2014 8.0994 114.3335 61.2256 62.6444 176.3323 237 W 4.1355 8.2527 130.7552 60.3620 30.4332 177.9552 238 I 3.0665 8.2995 120.1082 64.2519 36.5125 178.4108 239 K 3.7063 8.2894 119.5602 59.6774 31.6374 179.5154 240 Q 3.8813 7.8802 117.3441 59.0860 28.9730 178.4894 241 T 3.7359 7.5481 117.1187 66.3984 68.2545 176.8256 242 I 2.3926 7.2074 115.0052 63.5218 37.1187 178.0800 243 A 4.0481 7.4255 120.9976 53.7398 18.1290 178.7172 244 S 4.7561 7.2691 111.6710 58.1827 63.6564 173.9896 245 N 4.6782 7.9657 125.6873 53.7238 39.6053 174.2648 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 4.25 1.77 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 1.39 0.87 0.85 0.00 0.00 17 V 8.33 4.24 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 1.04 0.00 0.00 0.87 0.00 0.00 18 G 8.90 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 0.00 0.00 0.00 19 G 7.71 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 0.00 0.00 0.00 0.00 20 Y 8.05 5.06 0.00 3.00 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 21 T 8.55 4.37 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 1.21 0.00 0.00 22 C 8.62 4.24 0.00 2.88 3.07 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 23 G 7.80 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 24 A 8.43 4.29 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 N 8.34 4.01 0.00 2.84 3.03 0.00 0.00 6.66 7.06 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 26 T 7.50 4.33 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 1.26 0.00 0.00 27 V 7.07 4.03 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 0.31 0.00 0.00 0.79 0.00 0.00 28 P 0.00 4.49 0.00 2.36 2.36 0.00 3.65 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 2.22 2.01 0.00 29 Y 6.59 5.13 0.00 3.24 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 Q 7.36 4.61 0.00 1.82 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.45 0.00 0.00 0.00 0.00 0.00 1.99 2.48 0.00 31 V 8.73 4.85 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 0.87 0.00 0.00 1.01 0.00 0.00 32 S 8.78 4.93 0.00 3.22 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.53 4.85 0.00 0.62 0.79 0.81 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.24 6.00 0.00 2.46 2.55 0.00 0.00 6.60 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 *37 S 8.38 4.42 0.00 3.64 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 38 G 9.00 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 0.00 0.00 0.00 39 Y 6.49 4.67 0.00 3.10 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 40 H 8.74 4.83 0.00 2.89 3.19 0.00 5.86 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.30 5.12 0.00 3.08 3.15 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 0.00 42 C 6.80 4.89 0.00 2.09 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 43 G 8.80 4.40 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 0.00 0.00 0.00 44 G 8.20 4.50 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.82 5.42 0.00 3.83 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 46 L 9.23 4.84 0.00 1.86 1.66 1.08 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.40 4.51 1.90 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 1.51 0.99 0.95 0.00 0.00 48 N 7.90 4.38 0.00 2.94 2.97 0.00 0.00 6.43 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.31 4.14 0.00 4.04 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 0.00 50 Q 8.18 4.48 0.00 2.05 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.83 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 51 W 8.13 5.46 0.00 3.20 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 52 V 9.21 5.10 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 1.13 0.00 0.00 0.99 0.00 0.00 53 V 8.73 4.95 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 0.77 0.00 0.00 1.01 0.00 0.00 54 S 8.73 5.08 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 55 A 8.74 4.95 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 56 A 8.15 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.07 4.75 0.00 3.37 3.54 0.00 5.54 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.76 4.89 0.00 3.21 3.34 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 59 Y 7.59 4.32 0.00 2.98 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 7.21 3.89 0.00 1.25 1.19 0.00 0.61 0.00 0.00 1.02 0.00 0.00 2.60 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.94 0.79 7.81 61 S 7.89 4.39 0.00 3.74 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 62 G 8.33 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 63 I 7.31 4.45 1.89 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.60 0.96 0.00 0.00 64 Q 8.82 4.84 0.00 2.03 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.80 0.00 0.00 0.00 0.00 0.00 2.14 2.31 0.00 65 V 8.92 4.75 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 0.88 0.00 0.00 0.91 0.00 0.00 66 R 8.67 5.24 0.00 1.60 1.90 0.00 2.66 0.00 0.00 2.38 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 1.23 0.00 67 L 9.28 4.84 0.00 1.58 1.61 0.96 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 *69 G 8.24 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 0.00 0.00 0.00 0.00 70 E 8.51 4.89 0.00 2.17 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 2.37 2.18 0.00 71 D 8.64 4.83 0.00 2.89 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 8.23 5.43 0.00 2.76 2.75 0.00 0.00 7.16 7.69 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 73 I 8.52 3.82 1.47 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.55 -0.42 0.00 0.00 74 N 8.91 4.83 0.00 2.78 2.86 0.00 0.00 6.57 7.93 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 75 V 7.46 4.32 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 0.74 0.00 0.00 1.00 0.00 0.00 76 V 8.52 4.28 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 0.81 0.00 0.00 1.12 0.00 0.00 77 E 9.10 4.56 0.00 2.16 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 2.28 2.38 0.00 78 G 8.31 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 0.00 0.00 0.00 79 N 7.92 4.90 0.00 2.77 2.82 0.00 0.00 6.84 8.57 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 80 E 7.87 4.84 0.00 1.28 1.98 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 2.56 2.65 0.00 81 Q 8.61 4.39 0.00 2.02 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.75 0.00 0.00 0.00 0.00 0.00 2.22 2.27 0.00 82 F 8.87 5.63 0.00 2.80 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 83 I 9.14 4.70 1.88 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 1.25 0.89 0.95 0.00 0.00 84 S 8.59 4.95 0.00 3.76 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 8.35 4.58 1.21 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 86 S 8.73 4.62 0.00 3.79 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 87 K 7.48 4.71 0.00 1.86 1.90 0.00 1.47 0.00 0.00 1.94 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.28 1.52 7.81 88 S 8.66 5.31 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 89 I 9.16 4.64 2.04 0.00 0.00 1.00 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 0.93 1.14 0.00 0.00 90 V 8.44 4.50 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.75 0.00 0.00 91 H 8.61 3.60 0.00 2.83 2.97 0.00 5.67 0.00 0.00 0.00 0.00 6.65 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 4.16 0.00 2.13 2.18 0.00 2.92 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.88 0.00 93 S 7.73 4.62 0.00 4.06 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 94 Y 8.08 4.27 0.00 2.86 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 95 N 8.43 4.60 0.00 2.60 2.47 0.00 0.00 6.45 6.94 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 96 S 7.71 4.05 0.00 3.98 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 N 8.20 4.39 0.00 2.81 2.78 0.00 0.00 6.83 6.96 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 98 T 7.71 3.92 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 1.10 0.00 0.00 99 L 7.66 3.80 0.00 1.38 1.85 0.79 1.02 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 0.00 100 N 7.86 4.56 0.00 2.74 2.64 0.00 0.00 7.16 6.80 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 0.00 101 N 8.67 5.05 0.00 3.11 2.74 0.00 0.00 7.28 8.38 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 0.00 102 D 7.76 4.61 0.00 3.16 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 0.00 103 I 7.15 4.90 1.45 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 1.39 1.35 0.10 0.00 0.00 104 M 8.98 5.44 0.00 2.15 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 2.69 2.66 0.00 105 L 9.53 5.50 0.00 1.66 1.73 -0.03 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 0.00 106 I 9.14 5.05 1.94 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 1.22 0.99 0.91 0.00 0.00 107 K 8.64 3.84 0.00 0.79 1.08 0.00 1.37 0.00 0.00 1.32 0.00 0.00 2.61 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.55 0.21 7.81 108 L 8.07 4.55 0.00 1.43 1.57 0.98 0.82 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 0.00 109 K 8.78 4.05 0.00 1.94 1.80 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.38 7.81 110 S 7.79 4.75 0.00 3.83 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 A 8.27 4.46 1.21 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 0.00 112 A 8.49 4.37 1.30 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 0.00 0.00 0.00 113 S 9.08 4.67 0.00 3.72 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 0.00 114 L 8.54 4.54 0.00 1.66 1.72 0.96 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.77 4.79 0.00 2.89 2.90 0.00 0.00 6.78 8.51 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 0.00 116 S 8.79 4.27 0.00 3.89 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 0.00 117 R 8.54 4.30 0.00 1.90 2.07 0.00 3.07 0.00 0.00 3.01 7.18 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.56 4.97 0.00 4.00 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 0.00 128 C 8.36 4.51 0.00 2.94 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 0.00 129 A 7.26 4.50 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.08 4.24 0.00 3.96 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 *132 A 8.19 4.18 1.27 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 0.00 0.00 133 G 9.12 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 0.00 0.00 0.00 0.00 134 T 7.45 3.88 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 1.14 0.00 0.00 135 Q 8.53 4.70 0.00 1.92 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.80 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 136 C 9.34 5.30 0.00 2.82 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 0.00 137 L 8.91 5.26 0.00 1.76 1.54 1.01 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.06 5.32 1.88 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 1.51 0.99 0.00 0.00 139 S 9.28 4.94 0.00 3.51 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 0.00 140 G 6.93 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 0.00 141 W 8.52 4.53 0.00 3.24 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 0.00 142 G 8.54 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 0.00 143 N 7.52 3.55 0.00 2.21 2.58 0.00 0.00 7.34 7.23 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 0.00 144 T 8.17 5.13 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 1.26 0.00 0.00 145 K 7.97 4.52 0.00 1.82 1.75 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.32 1.33 7.81 146 S 8.85 4.18 0.00 3.83 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 0.00 147 S 9.18 4.54 0.00 3.90 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 0.00 148 G 7.04 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 0.00 149 T 7.81 4.93 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 1.50 0.00 0.00 150 S 9.60 4.67 0.00 3.85 3.64 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 0.00 151 Y 8.75 4.81 0.00 2.88 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 0.00 152 P 0.00 4.69 0.00 2.39 2.09 0.00 3.83 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 2.09 1.96 0.00 153 D 8.65 5.09 0.00 2.65 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 0.00 154 V 7.77 5.53 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 1.04 0.00 0.00 0.96 0.00 0.00 155 L 8.34 3.29 0.00 1.43 1.25 -1.04 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.18 4.85 0.00 1.72 1.46 0.00 1.44 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.25 1.41 7.81 157 C 8.62 5.27 0.00 1.32 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 L 8.36 4.91 0.00 1.72 1.44 1.04 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 159 K 8.99 5.08 0.00 1.81 1.82 0.00 1.82 0.00 0.00 1.76 0.00 0.00 2.73 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.48 1.64 7.81 160 A 9.41 4.98 1.21 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 0.00 161 P 0.00 5.03 0.00 2.02 2.10 0.00 3.14 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.76 0.00 162 I 8.36 4.29 1.88 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.59 0.78 0.00 0.00 163 L 8.64 4.88 0.00 1.55 1.61 0.92 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.18 4.40 0.00 4.05 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 0.00 165 D 8.77 4.45 0.00 2.74 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 8.05 4.18 0.00 4.05 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 8.09 4.26 0.00 4.09 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 0.00 168 C 8.17 4.36 0.00 3.23 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 K 8.45 3.99 0.00 1.84 1.92 0.00 1.80 0.00 0.00 1.80 0.00 0.00 3.13 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.56 1.60 7.81 170 S 8.29 4.28 0.00 4.04 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 A 7.41 3.86 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 0.00 172 Y 7.63 4.89 0.00 3.25 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 0.00 173 P 0.00 4.59 0.00 2.08 2.03 0.00 3.85 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.25 0.00 174 G 9.05 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 0.00 175 Q 8.22 4.59 0.00 2.50 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.48 6.35 0.00 0.00 0.00 0.00 0.00 2.27 2.57 0.00 176 I 7.85 4.45 1.99 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.95 1.01 0.00 0.00 177 T 8.14 4.70 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 178 S 8.56 4.34 0.00 4.01 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 0.00 179 N 8.06 4.93 0.00 2.85 3.11 0.00 0.00 6.59 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 M 7.97 5.58 0.00 1.89 2.00 0.00 0.00 0.00 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.62 0.00 181 F 8.65 5.16 0.00 3.09 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 9.29 5.97 0.00 2.95 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 A 8.94 4.98 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 6.79 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 0.00 184 Y 8.43 4.66 0.00 3.07 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 0.00 185 L 8.53 4.22 0.00 1.73 1.71 0.91 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.21 4.09 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 2.38 2.33 0.00 187 G 7.33 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188A G 8.79 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 K 7.03 4.80 0.00 1.66 1.72 0.00 1.44 0.00 0.00 0.77 0.00 0.00 2.50 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.17 1.36 7.81 189 D 8.27 4.59 0.00 2.82 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 S 8.80 4.66 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 0.00 191 C 9.12 4.74 0.00 2.92 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 0.00 192 Q 8.54 4.26 0.00 2.33 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 5.16 0.00 0.00 0.00 0.00 0.00 2.52 2.46 0.00 193 G 9.27 4.51 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 0.00 0.00 0.00 194 D 7.96 4.64 0.00 2.87 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 0.00 195 S 7.83 4.48 0.00 4.03 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 0.00 196 G 8.69 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 G 7.84 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 0.00 0.00 0.00 0.00 198 P 0.00 5.13 0.00 2.33 2.35 0.00 3.69 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.20 0.00 199 V 8.47 4.61 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 0.84 0.00 0.00 0.68 0.00 0.00 200 V 8.85 4.95 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 0.87 0.00 0.00 0.70 0.00 0.00 201 C 8.77 5.11 0.00 2.79 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 0.00 202 S 9.82 3.60 0.00 3.92 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 0.00 203 G 8.40 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 0.00 204 K 7.82 4.39 0.00 1.69 1.65 0.00 1.86 0.00 0.00 1.53 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.30 1.44 7.81 *209 L 8.23 4.32 0.00 1.52 1.65 1.03 0.74 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 8.55 4.60 0.00 1.96 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.60 0.00 0.00 0.00 0.00 0.00 2.46 2.18 0.00 211 G 8.55 5.37 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 0.00 212 I 8.17 5.09 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 1.12 0.95 0.00 0.00 213 V 8.99 3.93 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 1.22 0.00 0.00 214 S 8.46 4.69 0.00 3.90 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 0.00 215 W 7.19 4.91 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 8.14 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 0.00 0.00 0.00 217 S 8.37 4.73 0.00 4.25 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 *219 G 8.00 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 C 8.45 4.96 0.00 2.94 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221A A 8.69 3.83 1.47 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 0.00 221 Q 7.47 4.59 0.00 2.07 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 7.11 0.00 0.00 0.00 0.00 0.00 2.58 2.46 0.00 222 K 8.31 4.40 0.00 1.72 1.71 0.00 1.90 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.54 7.81 223 N 9.33 4.29 0.00 2.83 2.84 0.00 0.00 6.77 7.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 K 7.55 4.30 0.00 1.74 1.79 0.00 1.60 0.00 0.00 1.32 0.00 0.00 2.84 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.48 7.81 225 P 0.00 4.63 0.00 2.22 2.10 0.00 3.69 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.99 0.00 226 G 8.45 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 0.00 227 V 7.67 4.39 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 0.41 0.00 0.00 -0.81 0.00 0.00 228 Y 8.11 4.95 0.00 1.43 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 0.00 229 T 8.50 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 1.17 0.00 0.00 230 K 9.28 5.15 0.00 2.14 1.94 0.00 1.84 0.00 0.00 1.80 0.00 0.00 2.91 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.55 1.70 7.81 231 V 8.77 3.97 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 1.14 0.00 0.00 232 C 8.40 4.32 0.00 3.18 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 N 7.93 4.36 0.00 2.43 2.37 0.00 0.00 6.82 7.17 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 0.00 234 Y 7.94 4.84 0.00 3.12 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 V 8.09 3.67 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 1.08 0.00 0.00 1.11 0.00 0.00 236 S 8.10 4.20 0.00 3.97 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 0.00 237 W 8.25 4.14 0.00 3.43 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 0.00 238 I 8.30 3.07 2.01 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.03 0.74 0.00 0.00 239 K 8.29 3.71 0.00 1.78 1.79 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.57 7.81 240 Q 7.88 3.88 0.00 2.02 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.96 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 241 T 7.55 3.74 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 0.80 0.00 0.00 242 I 7.21 2.39 0.72 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 1.29 0.80 -0.31 0.00 0.00 243 A 7.43 4.05 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 244 S 7.27 4.76 0.00 3.81 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 0.00 245 N 7.97 4.68 0.00 2.96 2.98 0.00 0.00 6.71 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 * Residues marked with a * may have inaccurate shift predictions.