NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 L 4.2156 8.2845 122.4885 54.1887 42.4707 176.7533 10 K 3.8638 8.4713 130.4720 54.9842 32.5108 171.2639 11 Q 4.7870 8.7762 126.4202 54.0712 31.0646 174.0689 12 I 4.7901 8.1760 124.2628 59.0228 41.5554 175.0505 13 S 4.3710 8.5740 121.8266 57.8744 64.1553 174.9509 14 R 3.8052 8.7698 122.3810 60.1042 29.4488 179.4194 15 V 3.6387 7.5463 109.8920 64.2492 31.8550 178.0145 16 E 4.0573 8.2030 118.3363 59.1289 29.3971 178.9885 17 A 3.9030 8.2791 121.2292 55.4737 18.2328 179.4679 18 M 4.1597 7.8890 115.6395 57.5643 32.0976 177.5249 19 R 4.3233 7.4810 116.4198 56.1390 30.8829 176.8912 20 L 4.0202 7.4184 118.2514 54.0884 42.2883 177.3268 21 G 3.9955 8.6512 110.0391 45.1163 0.0000 172.8559 22 P 4.3625 0.0000 0.0000 64.7650 31.4022 178.0558 23 G 3.6772 8.1271 105.7114 46.7168 0.0000 173.2847 24 W 4.7455 8.2587 120.8894 55.7796 30.1964 176.4292 25 S 4.9036 8.8644 120.8090 57.9724 64.7581 172.7881 26 H 5.5030 9.0997 119.0015 54.2329 31.9566 172.5856 27 S 5.1782 9.2297 117.9319 56.6319 65.4386 172.3640 28 C 5.5954 8.9783 123.2068 58.4876 31.6013 172.8497 29 H 5.5543 9.5900 119.1450 54.0363 33.2826 171.9956 30 A 5.0699 8.9234 122.7724 50.4663 21.4368 175.8115 31 M 4.2014 9.0635 123.6693 54.1300 33.3112 174.3682 32 L 5.2989 8.4458 127.0296 53.7286 43.8514 175.5486 33 Y 5.5342 8.5032 120.1015 55.9030 42.0954 173.5851 34 A 5.1903 9.4929 120.3901 49.3391 23.1589 175.5934 35 A 4.1380 8.8719 122.5699 52.2755 19.0437 176.7968 36 N 4.8285 8.8645 120.8802 51.0818 41.4266 172.7442 37 P 4.5150 0.0000 0.0000 62.8432 32.1863 176.8598 38 G 3.6540 8.3721 109.3155 45.8616 0.0000 173.1855 39 Q 4.7184 8.1398 118.5335 53.2327 31.1525 174.9903 40 L 3.8056 8.4165 126.5483 56.1341 42.4020 176.8833 41 F 4.0542 9.1174 122.5968 58.2868 36.6125 175.8693 42 G 4.0197 8.4324 105.8504 46.1325 0.0000 175.3002 43 R 4.4965 8.2458 113.6322 54.9251 31.6472 174.9259 44 I 4.2120 7.4216 119.9961 58.5639 37.8599 173.0657 45 P 4.6357 0.0000 0.0000 62.7459 31.6261 176.9032 46 M 4.2794 8.5792 123.8690 56.5671 32.2022 176.7776 47 R 3.9718 7.9051 120.4656 56.0701 29.3471 175.5574 48 F 5.4333 7.5799 114.1396 55.9855 43.6803 173.5201 49 S 4.8530 9.3485 117.2003 56.7983 65.8063 173.3697 50 V 4.9512 8.3840 123.4894 61.1185 34.6224 173.7963 51 L 5.1141 8.7272 127.0847 54.0118 43.0861 175.7039 52 M 5.2050 9.0590 122.9365 53.9568 36.8036 173.8785 53 Q 4.9958 8.9021 115.8695 55.4018 32.8496 173.5020 54 M 4.4742 9.0984 121.6681 55.2717 33.3619 176.1208 55 R 4.8014 8.8053 126.0813 54.9076 31.6758 177.6417 56 F 4.1463 8.7099 116.3532 59.8097 37.6520 175.9836 57 D 4.4316 6.8607 118.4806 52.8216 39.2894 176.9524 58 G 3.8189 8.2084 107.1314 45.7357 0.0000 173.3702 59 L 4.7742 7.1914 117.9749 52.3822 44.9944 175.8724 60 L 4.5100 8.2887 122.3340 54.9140 43.0867 176.4839 61 G 4.2881 8.6513 108.7066 45.5335 0.0000 171.7179 62 F 5.1492 8.4907 118.1914 55.8300 40.2905 174.5457 63 P 4.2225 0.0000 0.0000 63.6882 32.2592 176.6737 64 G 3.9485 8.8595 109.3054 46.4757 0.0000 171.4691 65 G 3.8442 7.1960 107.4009 45.7788 0.0000 171.3487 66 F 4.8323 8.5748 118.1709 57.5250 39.7166 175.3127 67 V 4.4761 8.8851 123.6784 61.2319 33.4086 174.7366 68 D 4.8009 9.0612 128.0998 53.5846 41.3304 176.8275 69 R 4.6660 8.6891 124.6959 57.3239 30.4479 178.4724 70 R 3.8247 7.8363 116.6227 58.0079 30.2320 177.3556 71 F 4.3740 7.7718 115.2250 57.5502 40.7017 176.0194 72 W 5.4098 7.5553 118.5290 53.7843 32.7681 174.9777 73 S 4.4713 8.7501 116.5214 58.2899 64.3885 175.4082 74 L 4.0277 8.4562 121.8985 58.1338 41.3437 179.7856 75 E 3.7470 8.0754 117.8845 59.4217 29.3895 178.8688 76 D 4.3397 8.1334 118.0029 57.0281 41.1315 178.9257 77 G 3.5761 8.4095 106.4755 47.6193 0.0000 175.1030 78 L 3.8137 7.8372 123.6857 58.2568 41.7685 179.1048 79 N 4.3261 7.6072 113.6294 55.5404 38.4961 176.7229 80 R 4.2324 7.4601 117.5457 56.4351 30.8959 177.2293 81 V 4.3922 7.2469 111.4836 60.9190 32.3815 177.5817 82 L 3.9927 7.9616 122.0495 56.0665 41.5825 178.4055 83 G 4.1034 8.1976 104.0877 45.7591 0.0000 173.6222 84 L 4.3075 7.8158 118.0221 53.9198 42.0072 177.6807 85 G 3.9445 8.0681 105.9961 46.4199 0.0000 173.9556 86 L 4.5896 6.6794 125.8688 54.0609 39.8425 180.8675 *90 R 4.1236 8.4600 128.7411 56.8094 29.6366 174.5235 91 L 4.3739 8.8578 123.2552 54.6173 42.5468 176.9068 92 T 4.7463 8.9140 111.1445 59.9336 72.2268 174.2758 93 E 4.1331 8.8970 119.0590 59.5160 29.5159 179.5051 94 A 4.1202 7.9581 121.0684 54.7299 18.6221 177.8625 95 D 4.7318 8.3001 114.4108 54.7941 41.8111 175.9791 96 Y 3.8968 7.9690 122.2532 57.6354 39.2605 174.6576 97 L 4.2991 7.3623 126.0780 55.1468 43.4267 176.4429 98 S 4.1363 6.2167 109.7039 58.5010 66.2494 173.0045 99 S 5.2112 8.1379 116.5973 56.9395 66.7869 173.1868 100 H 5.3213 8.9868 120.1849 53.7513 32.6415 172.7975 101 L 4.4325 8.6216 123.5083 55.0639 41.5397 176.8931 102 T 3.9053 9.1145 116.9052 64.0809 70.3257 174.8748 *107 R 3.5255 7.3900 120.7843 55.0874 30.4269 174.3883 108 V 5.1399 7.4814 119.9914 61.2720 36.0616 174.6762 109 V 4.7177 9.0145 127.2980 61.3339 33.5413 174.0637 110 A 5.0133 9.1676 130.6279 50.8481 20.9141 174.9394 111 H 5.1978 9.4654 120.8474 54.7286 31.1128 174.1392 112 L 5.1641 8.8389 125.7306 53.4907 44.4746 174.6884 113 Y 5.2258 9.1427 123.0139 56.3518 41.7632 174.4611 114 A 5.2106 9.0778 122.6533 50.7666 23.1144 175.9066 115 R 4.5274 8.9371 120.5684 54.8670 33.8974 173.6749 116 Q 3.6597 8.5113 128.0151 55.3209 29.4935 174.6524 117 L 4.8922 8.6116 126.0052 52.5491 45.7644 176.1733 118 T 4.0281 8.7878 110.4165 61.1327 69.5941 175.5630 119 L 3.9327 8.4380 123.7570 58.3162 42.0208 179.1241 120 E 3.9822 8.1020 118.2293 59.5304 29.4829 179.1532 121 Q 4.0183 8.1255 118.1088 58.7085 28.8225 178.4850 122 L 3.9551 8.2321 121.7532 58.4137 42.1601 178.5257 123 H 4.7469 8.8263 119.5233 58.8006 29.7192 176.9492 124 A 3.9631 8.1407 122.5994 55.2146 18.0367 179.8377 125 V 3.5288 7.8439 116.7082 66.1610 31.4964 178.0746 126 E 3.9834 8.0897 117.8867 59.4313 29.0570 179.5226 127 I 3.6985 7.6008 118.7403 64.5085 37.2343 177.9326 128 S 4.2298 8.3142 113.9449 61.4705 62.1034 176.1313 129 A 4.1309 8.3249 123.8259 55.1685 17.9496 180.0440 130 V 3.3875 7.3966 116.5534 64.4468 31.4849 177.2844 131 H 4.6694 7.4610 114.2182 54.7925 29.2507 175.2899 132 S 4.4230 7.3327 116.8239 57.7819 62.9407 175.2569 133 R 4.0473 8.4378 123.2805 59.0214 30.0760 177.7400 134 D 4.5589 7.9441 116.5922 55.2756 41.3504 175.7930 135 H 4.3806 7.6954 120.3608 57.3855 30.0146 175.3201 136 G 3.9446 9.0884 115.2930 45.4169 0.0000 172.8778 137 L 4.3900 8.1480 116.9423 55.0783 43.0508 177.2291 138 E 4.3625 9.2244 130.0745 58.7125 31.8550 177.4792 139 V 4.7541 7.8684 119.7897 61.1129 34.0371 175.6113 140 L 4.5315 10.6841 127.1559 54.1829 42.8089 175.8831 141 G 4.2242 7.7083 110.5374 44.2536 0.0000 172.2696 142 L 4.8608 7.9133 123.4196 54.3656 42.9507 176.6557 143 V 4.6387 8.8158 114.1620 59.7473 36.1272 174.9063 144 R 4.7764 8.5326 122.3339 55.3567 31.3482 176.3047 145 V 3.0908 8.3863 124.7926 61.4991 32.1031 173.7563 146 P 4.1080 0.0000 0.0000 62.2128 31.6670 176.5681 147 L 3.6421 7.8924 122.8572 54.8768 42.5629 176.3780 148 Y 4.5644 6.8038 117.3075 56.8972 39.9293 174.3863 149 T 5.2218 8.3720 116.1259 61.8884 71.6026 174.3287 150 Q 4.4417 9.4460 125.7610 55.2485 30.0237 177.5162 151 K 4.0224 8.7665 119.3378 59.5937 32.1943 178.2122 152 D 4.4743 8.1364 116.3734 53.6508 39.5537 177.4556 153 R 4.0484 8.1561 117.8188 56.9986 28.5586 177.0006 154 V 4.3024 7.8346 110.8721 62.1390 34.7202 176.6038 155 G 4.3030 8.2820 109.3503 46.5279 0.0000 171.0096 156 G 4.1436 8.6342 109.3431 43.9041 0.0000 175.1910 157 F 4.5945 9.5364 127.9948 60.0511 38.7710 174.4496 158 P 4.0817 0.0000 0.0000 65.6595 31.5268 177.7539 159 N 4.4489 8.2644 115.2086 56.4487 38.4913 177.0223 160 F 4.0826 8.4577 121.8584 61.4591 39.3246 177.0090 161 L 4.1316 7.9736 116.6179 56.5058 41.4632 178.4899 162 S 4.4460 7.6508 112.9611 58.6354 63.6557 173.7815 163 N 4.3518 7.7313 120.3417 53.1000 39.3037 173.3029 164 A 4.6673 7.8216 120.1913 50.6654 20.8229 176.1832 165 F 5.2177 8.6411 120.9620 55.1118 42.4178 175.8775 166 V 3.8273 8.6688 121.9489 61.1907 32.7296 175.5551 167 S 4.2085 8.5842 116.2328 60.8429 62.6735 174.0238 168 T 3.6937 8.8953 123.1300 64.2901 67.2256 173.9218 169 A 4.3748 8.0178 124.2544 54.4301 18.2811 179.5945 170 K 3.3328 7.7789 117.5673 59.6541 32.2288 178.6951 171 C 4.1038 7.8857 116.4880 62.8955 28.1176 175.9204 172 Q 4.0513 8.5553 120.0587 58.7998 28.2547 178.5745 173 L 4.3932 8.4313 121.5719 58.5057 42.2342 179.1596 174 L 4.0542 8.0130 118.8538 57.5717 41.4893 179.2852 175 F 4.0862 8.6345 120.7722 61.2421 39.2928 177.0739 176 A 3.7198 8.4323 120.7083 55.1106 18.1679 179.4556 177 L 3.6064 7.9709 117.6375 57.6942 41.6365 179.7786 178 K 3.7856 7.6562 118.8773 59.7381 32.0649 179.5117 179 V 3.4599 7.2156 111.0588 63.6526 31.5535 177.1927 180 L 4.1825 7.7122 118.0209 53.9457 41.5343 176.1017 181 N 4.1369 7.5375 115.0669 54.6084 36.5168 175.3914 182 M 4.0317 7.8147 118.6937 57.0511 32.7621 177.2247 183 M 4.8169 7.3840 116.1547 51.7519 36.4937 173.5345 184 P 4.3495 0.0000 0.0000 62.4164 33.3991 177.1880 185 E 3.8984 8.7827 121.8271 59.6097 29.5345 178.7883 186 E 3.9099 8.2435 118.6328 59.5270 29.6102 178.9205 187 K 4.1171 7.9014 117.8042 59.1507 32.2373 179.2870 188 L 4.1495 7.9443 119.3863 57.6898 41.5258 179.5806 189 V 3.5735 8.0440 118.4155 65.9401 31.4090 177.5389 190 E 3.9006 8.2086 118.7827 59.3475 29.4196 178.6798 191 A 3.9676 8.1668 120.6724 55.0944 18.4548 179.3858 192 L 3.7322 8.0119 118.6306 58.0872 42.0922 178.9711 193 A 3.9451 8.1844 120.6075 55.0927 18.2992 179.4480 194 A 3.8865 8.2646 119.2006 55.1594 18.3983 179.5445 195 A 3.8969 8.0624 119.3523 55.8367 18.4106 180.1182 196 T 3.9641 7.9977 114.1262 66.6382 68.4582 176.6815 197 E 3.8951 8.3662 121.4599 59.0541 29.6443 178.7578 198 K 3.8860 8.1878 119.6285 59.6902 32.3120 178.6812 199 Q 3.9831 8.2308 118.3984 58.7867 28.6083 178.8413 200 K 3.9059 8.1913 120.5463 59.5898 32.2153 178.9931 201 K 4.0994 8.2697 118.6165 59.4002 31.6901 179.2759 202 A 3.9826 8.1286 121.0961 55.0964 18.3030 179.5089 203 L 3.9204 8.0783 118.8819 58.2276 41.9068 179.0294 204 E 3.9936 8.1862 117.9911 59.1304 29.3846 179.0976 205 K 4.1291 7.6854 117.7970 59.4349 32.1770 179.0473 206 L 4.2256 7.5452 118.1333 56.7153 41.6675 177.0961 207 L 4.3504 8.0112 122.7886 54.8596 42.6501 176.0332 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 9 L 8.28 4.22 0.00 1.56 1.62 0.96 0.13 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 10 K 8.47 3.86 0.00 1.57 1.70 0.00 1.83 0.00 0.00 1.78 0.00 0.00 2.76 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.45 1.07 7.81 11 Q 8.78 4.79 0.00 1.97 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.73 0.00 0.00 0.00 0.00 0.00 2.09 1.96 0.00 12 I 8.18 4.79 1.77 0.00 0.00 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 1.21 0.93 0.88 0.00 0.00 13 S 8.57 4.37 0.00 4.03 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 R 8.77 3.81 0.00 1.15 1.64 0.00 2.21 0.00 0.00 2.77 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.37 0.00 15 V 7.55 3.64 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 0.77 0.00 0.00 0.89 0.00 0.00 16 E 8.20 4.06 0.00 1.99 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 2.29 2.28 0.00 17 A 8.28 3.90 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 18 M 7.89 4.16 0.00 1.99 2.25 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.53 0.00 19 R 7.48 4.32 0.00 1.92 1.94 0.00 3.14 0.00 0.00 3.19 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.76 0.00 20 L 7.42 4.02 0.00 1.60 1.10 0.13 0.17 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 21 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 22 P 0.00 4.36 0.00 2.08 2.17 0.00 3.74 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.13 0.00 23 G 8.13 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 24 W 8.26 4.75 0.00 3.36 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 25 S 8.86 4.90 0.00 3.94 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 26 H 9.10 5.50 0.00 3.24 3.43 0.00 5.57 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 S 9.23 5.18 0.00 3.39 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 28 C 8.98 5.60 0.00 2.88 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 29 H 9.59 5.55 0.00 3.19 3.34 0.00 5.75 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 A 8.92 5.07 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 M 9.06 4.20 0.00 1.81 1.08 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.52 0.00 32 L 8.45 5.30 0.00 1.72 1.60 0.95 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 33 Y 8.50 5.53 0.00 3.23 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 34 A 9.49 5.19 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 35 A 8.87 4.14 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 N 8.86 4.83 0.00 2.70 2.61 0.00 0.00 6.73 7.29 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 37 P 0.00 4.51 0.00 2.16 2.07 0.00 3.77 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.91 0.00 38 G 8.37 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 39 Q 8.14 4.72 0.00 1.97 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 7.04 0.00 0.00 0.00 0.00 0.00 2.27 2.20 0.00 40 L 8.42 3.81 0.00 1.08 0.87 0.35 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 41 F 9.12 4.05 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 42 G 8.43 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 0.00 0.00 0.00 43 R 8.25 4.50 0.00 1.88 2.00 0.00 3.07 0.00 0.00 3.25 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.64 0.00 44 I 7.42 4.21 1.51 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 0.75 0.63 0.00 0.00 45 P 0.00 4.64 0.00 2.02 1.95 0.00 3.66 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.21 0.00 46 M 8.58 4.28 0.00 2.09 2.10 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 1.66 1.44 0.68 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 113 Y 9.14 5.23 0.00 2.84 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 0.00 114 A 9.08 5.21 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 R 8.94 4.53 0.00 1.93 1.73 0.00 3.10 0.00 0.00 3.06 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.53 0.00 116 Q 8.51 3.66 0.00 1.56 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.57 0.00 0.00 0.00 0.00 0.00 2.09 1.79 0.00 117 L 8.61 4.89 0.00 1.48 1.59 0.90 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 118 T 8.79 4.03 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 119 L 8.44 3.93 0.00 1.92 1.70 0.93 0.91 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 0.00 120 E 8.10 3.98 0.00 2.09 1.99 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 0.00 129 A 8.32 4.13 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 V 7.40 3.39 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 0.64 0.00 0.00 0.73 0.00 0.00 131 H 7.46 4.67 0.00 3.26 3.35 0.00 5.65 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 S 7.33 4.42 0.00 3.90 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 0.00 133 R 8.44 4.05 0.00 1.85 1.99 0.00 3.25 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 134 D 7.94 4.56 0.00 2.70 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 0.00 135 H 7.70 4.38 0.00 3.24 3.38 0.00 5.99 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 G 9.09 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 0.00 0.00 0.00 137 L 8.15 4.39 0.00 1.77 1.39 0.99 0.67 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 0.00 138 E 9.22 4.36 0.00 2.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.23 0.00 139 V 7.87 4.75 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 1.14 0.00 0.00 1.01 0.00 0.00 140 L 10.68 4.53 0.00 1.62 1.67 0.97 0.99 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 0.00 141 G 7.71 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 0.00 0.00 0.00 0.00 142 L 7.91 4.86 0.00 1.59 1.66 0.97 0.97 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 0.00 143 V 8.82 4.64 2.19 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 0.81 0.00 0.00 1.14 0.00 0.00 144 R 8.53 4.78 0.00 1.70 1.84 0.00 3.22 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.75 0.00 145 V 8.39 3.09 1.85 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 0.25 0.00 0.00 0.77 0.00 0.00 146 P 0.00 4.11 0.00 1.37 1.87 0.00 3.01 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.93 0.00 147 L 7.89 3.64 0.00 1.49 1.42 0.83 0.13 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 0.00 148 Y 6.80 4.56 0.00 3.11 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 0.00 149 T 8.37 5.22 4.35 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 150 Q 9.45 4.44 0.00 2.24 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.79 0.00 0.00 0.00 0.00 0.00 2.56 2.66 0.00 151 K 8.77 4.02 0.00 2.04 1.91 0.00 1.86 0.00 0.00 1.76 0.00 0.00 2.96 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.44 1.00 7.81 152 D 8.14 4.47 0.00 2.93 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 0.00 153 R 8.16 4.05 0.00 2.04 2.15 0.00 3.12 0.00 0.00 3.25 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.75 0.00 154 V 7.83 4.30 2.27 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 0.79 0.00 0.00 1.05 0.00 0.00 155 G 8.28 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 0.00 0.00 0.00 0.00 156 G 8.63 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 F 9.54 4.59 0.00 3.08 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 0.00 158 P 0.00 4.08 0.00 2.23 2.08 0.00 3.98 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 2.22 2.22 0.00 159 N 8.26 4.45 0.00 2.98 2.94 0.00 0.00 6.72 7.75 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 0.00 160 F 8.46 4.08 0.00 3.29 3.35 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.97 4.13 0.00 1.54 1.47 0.03 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 162 S 7.65 4.45 0.00 4.01 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 0.00 163 N 7.73 4.35 0.00 2.14 2.24 0.00 0.00 6.79 7.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 A 7.82 4.67 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 0.00 165 F 8.64 5.22 0.00 2.77 2.85 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 0.00 166 V 8.67 3.83 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.92 0.00 0.00 167 S 8.58 4.21 0.00 3.87 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 0.00 168 T 8.90 3.69 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 1.20 0.00 0.00 169 A 8.02 4.37 1.38 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 0.00 0.00 170 K 7.78 3.33 0.00 1.21 1.54 0.00 1.24 0.00 0.00 1.58 0.00 0.00 2.74 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.14 0.59 7.81 171 C 7.89 4.10 0.00 3.07 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Q 8.56 4.05 0.00 2.49 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.79 0.00 0.00 0.00 0.00 0.00 2.39 2.54 0.00 173 L 8.43 4.39 0.00 1.97 1.95 1.13 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 174 L 8.01 4.05 0.00 1.78 1.73 0.84 1.08 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 0.00 175 F 8.63 4.09 0.00 3.12 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 0.00 176 A 8.43 3.72 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 0.00 177 L 7.97 3.61 0.00 1.62 1.58 0.89 0.57 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 0.00 178 K 7.66 3.79 0.00 1.81 1.74 0.00 1.73 0.00 0.00 1.61 0.00 0.00 2.84 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.29 1.39 7.81 179 V 7.22 3.46 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 -0.09 0.00 0.00 0.46 0.00 0.00 180 L 7.71 4.18 0.00 1.33 1.41 0.54 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 181 N 7.54 4.14 0.00 2.82 2.85 0.00 0.00 6.90 7.03 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 0.00 182 M 7.81 4.03 0.00 1.26 1.75 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.10 0.00 183 M 7.38 4.82 0.00 1.90 1.79 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.48 0.00 184 P 0.00 4.35 0.00 2.16 1.97 0.00 3.61 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.15 0.00 185 E 8.78 3.90 0.00 2.00 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 2.38 2.38 0.00 186 E 8.24 3.91 0.00 2.08 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 2.42 0.00 187 K 7.90 4.12 0.00 1.97 1.89 0.00 1.78 0.00 0.00 1.85 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.55 1.49 7.81 188 L 7.94 4.15 0.00 1.92 1.77 0.96 0.87 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 0.00 189 V 8.04 3.57 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 1.00 0.00 0.00 1.00 0.00 0.00 190 E 8.21 3.90 0.00 2.20 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 191 A 8.17 3.97 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 L 8.01 3.73 0.00 1.69 1.76 0.80 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 193 A 8.18 3.95 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 0.00 194 A 8.26 3.89 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 0.00 195 A 8.06 3.90 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.00 3.96 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 1.19 0.00 0.00 197 E 8.37 3.90 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 198 K 8.19 3.89 0.00 1.93 1.98 0.00 1.85 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.43 1.49 7.81 199 Q 8.23 3.98 0.00 2.27 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.54 0.00 200 K 8.19 3.91 0.00 1.81 1.97 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.48 7.81 201 K 8.27 4.10 0.00 1.96 1.84 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.59 7.81 202 A 8.13 3.98 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.08 3.92 0.00 1.90 1.79 0.91 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 204 E 8.19 3.99 0.00 2.14 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.46 0.00 205 K 7.69 4.13 0.00 1.91 1.87 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.61 7.81 206 L 7.55 4.23 0.00 1.74 1.72 0.91 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 207 L 8.01 4.35 0.00 1.65 1.49 0.91 0.69 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 * Residues marked with a * may have inaccurate shift predictions.